3-phenyl-N-[[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide

Systemtic Name: 3-phenyl-N-[[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide Openeye Name: 3-phenyl-N-[[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide CAS Name: 3-phenyl-N-[[4-[(4-phenyl-1-piperazinyl)sulfonyl]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-phenyl-N-[[4-(4-phenylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide Traditional Name: 3-phenyl-N-[[4-(4-phenylpiperazino)sulfonylphenyl]thiocarbamoyl]propionamide Formula: C26H28N4O3S2 MolecularWeight: 508.65552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O3S2/c31-25(16-11-21-7-3-1-4-8-21)28-26(34)27-22-12-14-24(15-13-22)35(32,33)30-19-17-29(18-20-30)23-9-5-2-6-10-23/h1-10,12-15H,11,16-20H2,(H2,27,28,31,34)