N-(4-nitrophenyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-nitrophenyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3S/c23-17(14-4-2-1-3-5-14)20-10-12-21(13-11-20)18(26)19-15-6-8-16(9-7-15)22(24)25/h1-9H,10-13H2,(H,19,26)