N-(2,5-dimethylphenyl)-4-(phenylmethyl)piperidine-1-carbothioamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-(phenylmethyl)piperidine-1-carbothioamide Openeye Name: 4-benzyl-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide CAS Name: N-(2,5-dimethylphenyl)-4-(phenylmethyl)-1-piperidinecarbothioamide IUPAC Name: 4-benzyl-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide Traditional Name: 4-benzyl-N-(2,5-dimethylphenyl)piperidine-1-carbothioamide Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2S/c1-16-8-9-17(2)20(14-16)22-21(24)23-12-10-19(11-13-23)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3,(H,22,24)