N-[4-[4-methyl-2-(4-methyl-7-oxidanylidene-1,4-diazepan-1-yl)pentyl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[4-methyl-2-(4-methyl-7-oxidanylidene-1,4-diazepan-1-yl)pentyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[4-methyl-2-(4-methyl-7-oxo-1,4-diazepan-1-yl)pentyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[4-methyl-2-(4-methyl-7-oxo-1,4-diazepan-1-yl)pentyl]thio]phenyl]acetamide IUPAC Name: N-[4-[4-methyl-2-(4-methyl-7-oxo-1,4-diazepan-1-yl)pentyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[2-(7-keto-4-methyl-1,4-diazepan-1-yl)-4-methyl-pentyl]thio]phenyl]acetamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O2S/c1-15(2)13-18(23-12-11-22(4)10-9-20(23)25)14-26-19-7-5-17(6-8-19)21-16(3)24/h5-8,15,18H,9-14H2,1-4H3,(H,21,24)