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

Systemtic Name: N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-3-methyl-benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-methyl-benzamide CAS Name: N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-methylbenzamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-3-methyl-benzamide Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3OS/c1-20-9-8-14-23(19-20)25(30)27-26(31)29-17-15-28(16-18-29)24(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-14,19,24H,15-18H2,1H3,(H,27,30,31)