(E)-N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]anilino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[4-(4-benzhydrylpiperazino)sulfonylphenyl]thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C31H30N4O3S3 MolecularWeight: 602.7899

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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)C=CC5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=S)NC(=O)/C=C/C5=CC=CS5

InChI

InChI=1S/C31H30N4O3S3/c36-29(18-15-27-12-7-23-40-27)33-31(39)32-26-13-16-28(17-14-26)41(37,38)35-21-19-34(20-22-35)30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-18,23,30H,19-22H2,(H2,32,33,36,39)/b18-15+