N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]anilino]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[[4-(4-benzhydrylpiperazino)sulfonylphenyl]thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C36H34N4O3S2 MolecularWeight: 634.81016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=S)NC(=O)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=S)NC(=O)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C36H34N4O3S2/c41-34(26-30-16-9-15-27-10-7-8-17-33(27)30)38-36(44)37-31-18-20-32(21-19-31)45(42,43)40-24-22-39(23-25-40)35(28-11-3-1-4-12-28)29-13-5-2-6-14-29/h1-21,35H,22-26H2,(H2,37,38,41,44)