[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC(=O)COC(=O)CCCNC(=O)C2=CSC=C2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC(=O)COC(=O)CCCNC(=O)C2=CSC=C2

InChI

InChI=1S/C19H21N3O5S/c23-16(22-19(26)21-11-14-5-2-1-3-6-14)12-27-17(24)7-4-9-20-18(25)15-8-10-28-13-15/h1-3,5-6,8,10,13H,4,7,9,11-12H2,(H,20,25)(H2,21,22,23,26)