methyl 3-[(3-ethylsulfanylphenyl)carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-ethylsulfanylphenyl)carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(3-ethylsulfanylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[3-(ethylthio)phenyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-ethylsulfanylbenzoyl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[3-(ethylthio)benzoyl]amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19NO3S2/c1-3-26-16-11-7-10-15(12-16)20(23)22-17-13-18(14-8-5-4-6-9-14)27-19(17)21(24)25-2/h4-13H,3H2,1-2H3,(H,22,23)