ethyl 2-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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ethyl 2-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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CAS No:
511282-14-7
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Formula:
C17H21N3O3S3
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Chemical Name:
ethyl 2-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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Synonyms:
511282-14-7;ethyl 2-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate;ethyl 2-({[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate;CBKinase1_002714;CBKinase1_015114;MLS000535244;IFLab1_005699;CHEMBL1377637;REGID_for_CID_2139614;HMS1428D01;HMS2345F04;ZINC2696214;AKOS000812074;MCULE-7880033203;IDI1_011102;ethyl 2-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate;SMR000142681;SR-01000262307;SR-01000262307-1;BRD-K51870045-001-01-4;F1441-0657;Z275024766;ethyl 2-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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CAS No:
ethyl 2-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Basic Attributes
411.6 g/mol
411.07450506 g/mol
Computed Properties
Molecular Weight:411.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:411.07450506
Monoisotopic Mass:411.07450506
Topological Polar Surface Area:163
Heavy Atom Count:26
Complexity:511
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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