[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(1-propylbenzimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-propyl-2-benzimidazolyl)thio]acetic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-(1-propylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-propylbenzimidazol-2-yl)thio]acetic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2N1CCC

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2N1CCC

InChI

InChI=1S/C18H24N4O4S/c1-3-9-19-17(25)21-15(23)11-26-16(24)12-27-18-20-13-7-5-6-8-14(13)22(18)10-4-2/h5-8H,3-4,9-12H2,1-2H3,(H2,19,21,23,25)