N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]anilino]-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[[4-(4-benzhydrylpiperazino)sulfonylphenyl]thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C39H38N4O5S2 MolecularWeight: 706.87282

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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)C5=CC=C(C=C5)OCCOC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=S)NC(=O)C5=CC=C(C=C5)OCCOC6=CC=CC=C6

InChI

InChI=1S/C39H38N4O5S2/c44-38(32-16-20-35(21-17-32)48-29-28-47-34-14-8-3-9-15-34)41-39(49)40-33-18-22-36(23-19-33)50(45,46)43-26-24-42(25-27-43)37(30-10-4-1-5-11-30)31-12-6-2-7-13-31/h1-23,37H,24-29H2,(H2,40,41,44,49)