N-[(4-piperidin-1-ylphenyl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(4-piperidin-1-ylphenyl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(4-piperidin-1-ylphenyl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C22H27N3OS/c1-16(2)17-6-8-18(9-7-17)21(26)24-22(27)23-19-10-12-20(13-11-19)25-14-4-3-5-15-25/h6-13,16H,3-5,14-15H2,1-2H3,(H2,23,24,26,27)