N-phenyl-1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxamide

Systemtic Name: N-phenyl-1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxamide Openeye Name: 1-[(4-isopropylphenyl)carbamothioyl]-N-phenyl-piperidine-3-carboxamide CAS Name: N-phenyl-1-[(4-propan-2-ylanilino)-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: N-phenyl-1-[(4-propan-2-ylphenyl)carbamothioyl]piperidine-3-carboxamide Traditional Name: 1-(p-cumenylthiocarbamoyl)-N-phenyl-nipecotamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H27N3OS/c1-16(2)17-10-12-20(13-11-17)24-22(27)25-14-6-7-18(15-25)21(26)23-19-8-4-3-5-9-19/h3-5,8-13,16,18H,6-7,14-15H2,1-2H3,(H,23,26)(H,24,27)