N-[1-(3-bromophenyl)-5-methyl-1-oxidanylidene-hexan-3-yl]benzenecarbothioamide

Systemtic Name: N-[1-(3-bromophenyl)-5-methyl-1-oxidanylidene-hexan-3-yl]benzenecarbothioamide Openeye Name: N-[1-[2-(3-bromophenyl)-2-oxo-ethyl]-3-methyl-butyl]benzenecarbothioamide CAS Name: N-[1-(3-bromophenyl)-5-methyl-1-oxohexan-3-yl]benzenecarbothioamide IUPAC Name: N-[1-(3-bromophenyl)-5-methyl-1-oxohexan-3-yl]benzenecarbothioamide Traditional Name: N-[1-[2-(3-bromophenyl)-2-keto-ethyl]-3-methyl-butyl]thiobenzamide Formula: C20H22BrNOS MolecularWeight: 404.36378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C1=CC(=CC=C1)Br)NC(=S)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(CC(=O)C1=CC(=CC=C1)Br)NC(=S)C2=CC=CC=C2

InChI

InChI=1S/C20H22BrNOS/c1-14(2)11-18(22-20(24)15-7-4-3-5-8-15)13-19(23)16-9-6-10-17(21)12-16/h3-10,12,14,18H,11,13H2,1-2H3,(H,22,24)