[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(3-methylanilino)-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid [2-(3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylanilino)-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid [2-keto-2-(m-toluidino)ethyl] ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=CS2

InChI

InChI=1S/C17H18N2O4S/c1-12-4-2-5-13(10-12)19-15(20)11-23-16(21)7-8-18-17(22)14-6-3-9-24-14/h2-6,9-10H,7-8,11H2,1H3,(H,18,22)(H,19,20)