4-(azepan-1-ylcarbonyl)-N-(4-propan-2-ylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(4-propan-2-ylphenyl)piperidine-1-carbothioamide Openeye Name: 4-(azepane-1-carbonyl)-N-(4-isopropylphenyl)piperidine-1-carbothioamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(4-propan-2-ylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(4-propan-2-ylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(azepane-1-carbonyl)-N-p-cumenyl-piperidine-1-carbothioamide Formula: C22H33N3OS MolecularWeight: 387.58192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H33N3OS/c1-17(2)18-7-9-20(10-8-18)23-22(27)25-15-11-19(12-16-25)21(26)24-13-5-3-4-6-14-24/h7-10,17,19H,3-6,11-16H2,1-2H3,(H,23,27)