[1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(thiophen-3-ylcarbonylamino)propanoate

Systemtic Name: [1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(thiophen-3-ylcarbonylamino)propanoate Openeye Name: [2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(thiophene-3-carbonylamino)propanoate CAS Name: 3-[[oxo(3-thiophenyl)methyl]amino]propanoic acid [1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl] 3-(thiophene-3-carbonylamino)propanoate Traditional Name: 3-(3-thenoylamino)propionic acid [2-[(2-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)OC(=O)CCNC(=O)C2=CSC=C2

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1Cl)OC(=O)CCNC(=O)C2=CSC=C2

InChI

InChI=1S/C18H19ClN2O4S/c1-12(17(23)21-10-13-4-2-3-5-15(13)19)25-16(22)6-8-20-18(24)14-7-9-26-11-14/h2-5,7,9,11-12H,6,8,10H2,1H3,(H,20,24)(H,21,23)