2-(aminocarbonylamino)-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pentanamide

Systemtic Name: 2-(aminocarbonylamino)-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pentanamide Openeye Name: 3-methyl-N-[2-(p-tolylsulfanyl)ethyl]-2-ureido-pentanamide CAS Name: 2-(carbamoylamino)-3-methyl-N-[2-[(4-methylphenyl)thio]ethyl]pentanamide IUPAC Name: 2-(carbamoylamino)-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pentanamide Traditional Name: 3-methyl-N-[2-(p-tolylthio)ethyl]-2-ureido-valeramide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCSC1=CC=C(C=C1)C)NC(=O)N

Isomeric SMILES

CCC(C)C(C(=O)NCCSC1=CC=C(C=C1)C)NC(=O)N

InChI

InChI=1S/C16H25N3O2S/c1-4-12(3)14(19-16(17)21)15(20)18-9-10-22-13-7-5-11(2)6-8-13/h5-8,12,14H,4,9-10H2,1-3H3,(H,18,20)(H3,17,19,21)