(6S)-2-[(3-acetamidophenyl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (6S)-2-[(3-acetamidophenyl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (6S)-2-[(3-acetamidobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6S)-2-[[(3-acetamidophenyl)-oxomethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate IUPAC Name: (6S)-2-[(3-acetamidobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6S)-2-[(3-acetamidobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Formula: C19H19N2O4S- MolecularWeight: 371.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)[O-])NC(=O)C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)[O-])NC(=O)C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C19H20N2O4S/c1-10-6-7-14-15(8-10)26-18(16(14)19(24)25)21-17(23)12-4-3-5-13(9-12)20-11(2)22/h3-5,9-10H,6-8H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)/p-1/t10-/m0/s1