N-[5-methyl-1-oxidanylidene-1-phenyl-2-(phenylcarbonyl)hexan-3-yl]benzenecarbothioamide

Systemtic Name: N-[5-methyl-1-oxidanylidene-1-phenyl-2-(phenylcarbonyl)hexan-3-yl]benzenecarbothioamide Openeye Name: N-[1-(1-benzoyl-2-oxo-2-phenyl-ethyl)-3-methyl-butyl]benzenecarbothioamide CAS Name: N-(2-benzoyl-5-methyl-1-oxo-1-phenylhexan-3-yl)benzenecarbothioamide IUPAC Name: N-(2-benzoyl-5-methyl-1-oxo-1-phenylhexan-3-yl)benzenecarbothioamide Traditional Name: N-[1-(1-benzoyl-2-keto-2-phenyl-ethyl)-3-methyl-butyl]thiobenzamide Formula: C27H27NO2S MolecularWeight: 429.57378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2)NC(=S)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2)NC(=S)C3=CC=CC=C3

InChI

InChI=1S/C27H27NO2S/c1-19(2)18-23(28-27(31)22-16-10-5-11-17-22)24(25(29)20-12-6-3-7-13-20)26(30)21-14-8-4-9-15-21/h3-17,19,23-24H,18H2,1-2H3,(H,28,31)