methyl 2-[(2,4-dichlorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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methyl 2-[(2,4-dichlorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
structure -
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CAS No:
374545-58-1
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Formula:
C18H16Cl2N2O3S2
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Chemical Name:
methyl 2-[(2,4-dichlorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Synonyms:
C18H16Cl2N2O3S2;ZINC1438000;STK730641;AKOS001627185;MCULE-3478687416;SR-01000453022;SR-01000453022-1;374545-58-1;methyl 2-({[(2,4-dichlorobenzoyl)amino]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;methyl 2-({[(2,4-dichlorophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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CAS No:
methyl 2-[(2,4-dichlorobenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes
443.4 g/mol
441.9979401 g/mol
Computed Properties
Molecular Weight:443.4
XLogP3:5.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:441.9979401
Monoisotopic Mass:441.9979401
Topological Polar Surface Area:128
Heavy Atom Count:27
Complexity:595
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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