N-[[2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[2-(4-benzoylpiperazin-1-yl)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[2-(4-benzoyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[2-(4-benzoylpiperazin-1-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[2-(4-benzoylpiperazino)phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C23H22N4O2S2 MolecularWeight: 450.57638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CS3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CS3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S2/c28-21(20-11-6-16-31-20)25-23(30)24-18-9-4-5-10-19(18)26-12-14-27(15-13-26)22(29)17-7-2-1-3-8-17/h1-11,16H,12-15H2,(H2,24,25,28,30)