[1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: [1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: [2-(4-chloroanilino)-1-methyl-2-oxo-ethyl] 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid [1-(4-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chloroanilino)-1-oxopropan-2-yl] 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid [2-(4-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)C2=CSC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)C2=CSC=C2

InChI

InChI=1S/C18H19ClN2O4S/c1-12(17(23)21-15-6-4-14(19)5-7-15)25-16(22)3-2-9-20-18(24)13-8-10-26-11-13/h4-8,10-12H,2-3,9H2,1H3,(H,20,24)(H,21,23)