N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-3-(2-methylpropoxy)benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-isobutoxy-benzamide CAS Name: N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-(2-methylpropoxy)benzamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-isobutoxy-benzamide Formula: C29H33N3O2S MolecularWeight: 487.65622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O2S/c1-22(2)21-34-26-15-9-14-25(20-26)28(33)30-29(35)32-18-16-31(17-19-32)27(23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-15,20,22,27H,16-19,21H2,1-2H3,(H,30,33,35)