[1-[(2-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [1-[(2-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(2-carbamoylanilino)-1-methyl-2-oxo-ethyl] 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [1-(2-carbamoylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-carbamoylanilino)-1-oxopropan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid [2-(2-carbamoylanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)N)OC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)N)OC(=O)C2=CC3=C(S2)CCCC3

InChI

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