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

Systemtic Name: 4-[1-(4-bromophenyl)sulfanyl-4-methyl-pentan-2-yl]-1-methyl-1,4-diazepan-5-one Openeye Name: 4-[1-[(4-bromophenyl)sulfanylmethyl]-3-methyl-butyl]-1-methyl-1,4-diazepan-5-one CAS Name: 4-[1-[(4-bromophenyl)thio]-4-methylpentan-2-yl]-1-methyl-1,4-diazepan-5-one IUPAC Name: 4-[1-(4-bromophenyl)sulfanyl-4-methylpentan-2-yl]-1-methyl-1,4-diazepan-5-one Traditional Name: 4-[1-[[(4-bromophenyl)thio]methyl]-3-methyl-butyl]-1-methyl-1,4-diazepan-5-one Formula: C18H27BrN2OS MolecularWeight: 399.38878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CSC1=CC=C(C=C1)Br)N2CCN(CCC2=O)C

Isomeric SMILES

CC(C)CC(CSC1=CC=C(C=C1)Br)N2CCN(CCC2=O)C

InChI

InChI=1S/C18H27BrN2OS/c1-14(2)12-16(13-23-17-6-4-15(19)5-7-17)21-11-10-20(3)9-8-18(21)22/h4-7,14,16H,8-13H2,1-3H3