4-methyl-N-(4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-(4-phenylbutanoylamino)pentanamide

Systemtic Name: 4-methyl-N-(4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-(4-phenylbutanoylamino)pentanamide Openeye Name: N-(1-formyl-3-methylsulfanyl-propyl)-4-methyl-2-(4-phenylbutanoylamino)pentanamide CAS Name: 4-methyl-N-[4-(methylthio)-1-oxobutan-2-yl]-2-[(1-oxo-4-phenylbutyl)amino]pentanamide IUPAC Name: 4-methyl-N-(4-methylsulfanyl-1-oxobutan-2-yl)-2-(4-phenylbutanoylamino)pentanamide Traditional Name: N-[1-formyl-3-(methylthio)propyl]-4-methyl-2-(4-phenylbutanoylamino)valeramide Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCSC)C=O)NC(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(C(=O)NC(CCSC)C=O)NC(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C21H32N2O3S/c1-16(2)14-19(21(26)22-18(15-24)12-13-27-3)23-20(25)11-7-10-17-8-5-4-6-9-17/h4-6,8-9,15-16,18-19H,7,10-14H2,1-3H3,(H,22,26)(H,23,25)