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

Systemtic Name: N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[4-(1-piperidylmethyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(1-piperidinylmethyl)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[4-(piperidinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C23H29N3OS MolecularWeight: 395.56086

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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)CN3CCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C23H29N3OS/c1-17(2)19-8-10-20(11-9-19)22(27)25-23(28)24-21-12-6-18(7-13-21)16-26-14-4-3-5-15-26/h6-13,17H,3-5,14-16H2,1-2H3,(H2,24,25,27,28)