3-butoxy-N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 3-butoxy-N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-butoxy-benzamide CAS Name: 3-butoxy-N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-butoxybenzamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-butoxy-benzamide Formula: C29H33N3O2S MolecularWeight: 487.65622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O2S/c1-2-3-21-34-26-16-10-15-25(22-26)28(33)30-29(35)32-19-17-31(18-20-32)27(23-11-6-4-7-12-23)24-13-8-5-9-14-24/h4-16,22,27H,2-3,17-21H2,1H3,(H,30,33,35)