1-methyl-4-[4-methyl-1-(4-methylphenyl)sulfanyl-pentan-2-yl]-1,4-diazepan-5-one

Systemtic Name: 1-methyl-4-[4-methyl-1-(4-methylphenyl)sulfanyl-pentan-2-yl]-1,4-diazepan-5-one Openeye Name: 1-methyl-4-[3-methyl-1-(p-tolylsulfanylmethyl)butyl]-1,4-diazepan-5-one CAS Name: 1-methyl-4-[4-methyl-1-[(4-methylphenyl)thio]pentan-2-yl]-1,4-diazepan-5-one IUPAC Name: 1-methyl-4-[4-methyl-1-(4-methylphenyl)sulfanylpentan-2-yl]-1,4-diazepan-5-one Traditional Name: 1-methyl-4-[3-methyl-1-[(p-tolylthio)methyl]butyl]-1,4-diazepan-5-one Formula: C19H30N2OS MolecularWeight: 334.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(CC(C)C)N2CCN(CCC2=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(CC(C)C)N2CCN(CCC2=O)C

InChI

InChI=1S/C19H30N2OS/c1-15(2)13-17(14-23-18-7-5-16(3)6-8-18)21-12-11-20(4)10-9-19(21)22/h5-8,15,17H,9-14H2,1-4H3