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

Systemtic Name: N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-4-propan-2-yl-benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-isopropyl-benzamide CAS Name: N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-propan-2-ylbenzamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-isopropyl-benzamide Formula: C28H31N3OS MolecularWeight: 457.63024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3OS/c1-21(2)22-13-15-25(16-14-22)27(32)29-28(33)31-19-17-30(18-20-31)26(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-16,21,26H,17-20H2,1-2H3,(H,29,32,33)