2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]benzamide

Systemtic Name: 2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]benzamide Openeye Name: 2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-N-[2-oxo-2-(propylamino)ethyl]benzamide CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]-N-[2-oxo-2-(propylamino)ethyl]benzamide IUPAC Name: 2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanyl-N-[2-oxo-2-(propylamino)ethyl]benzamide Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]-N-[2-keto-2-(propylamino)ethyl]benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C21H22N4O3S/c1-2-10-23-19(26)13-24-21(28)17-8-3-4-9-18(17)29-14-20(27)25-16-7-5-6-15(11-16)12-22/h3-9,11H,2,10,13-14H2,1H3,(H,23,26)(H,24,28)(H,25,27)