[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(m-toluidino)ethyl]thio]acetic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CSCC(=O)NC1=CC=CC(=C1)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CSCC(=O)NC1=CC=CC(=C1)C

InChI

InChI=1S/C17H23N3O5S/c1-3-7-18-17(24)20-14(21)9-25-16(23)11-26-10-15(22)19-13-6-4-5-12(2)8-13/h4-6,8H,3,7,9-11H2,1-2H3,(H,19,22)(H2,18,20,21,24)