butan-2-yl 2-[(1-ethylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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butan-2-yl 2-[(1-ethylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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CAS No:
7167-49-9
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Formula:
C19H25N3O3S
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Chemical Name:
butan-2-yl 2-[(1-ethylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Synonyms:
2-Propen-1-one,3-(p-methoxyphenyl)-1-(4-nitropyrrol-2-yl)-(7CI,8CI); Butan-2-yl 2-[(1-ethylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate; 2-Propen-1-one,3-(4-methoxyphenyl)-1-(4-nitro-1H-pyrrol-2-yl);
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CAS No:
butan-2-yl 2-[(1-ethylpyrazole-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes
375.48500
375.16166284
DTXSID60413495
Computed Properties
Molecular Weight:375.5
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:375.16166284
Monoisotopic Mass:375.16166284
Topological Polar Surface Area:102
Heavy Atom Count:26
Complexity:518
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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