N-(2-nitrophenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(2-nitrophenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(2-nitrophenyl)-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-nitrophenyl)-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-nitrophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(2-nitrophenyl)-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O2S/c22-21(23)14-6-2-1-5-13(14)18-16(24)20-11-9-19(10-12-20)15-7-3-4-8-17-15/h1-8H,9-12H2,(H,18,24)