2-[4-(4-nitrophenyl)piperazin-1-yl]-N-pyridin-2-yl-2-sulfanylidene-ethanamide

Systemtic Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-pyridin-2-yl-2-sulfanylidene-ethanamide Openeye Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-(2-pyridyl)-2-thioxo-acetamide CAS Name: 2-[4-(4-nitrophenyl)-1-piperazinyl]-N-(2-pyridinyl)-2-sulfanylideneacetamide IUPAC Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-pyridin-2-yl-2-sulfanylideneacetamide Traditional Name: 2-[4-(4-nitrophenyl)piperazino]-N-(2-pyridyl)-2-thioxo-acetamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)C(=O)NC3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C17H17N5O3S/c23-16(19-15-3-1-2-8-18-15)17(26)21-11-9-20(10-12-21)13-4-6-14(7-5-13)22(24)25/h1-8H,9-12H2,(H,18,19,23)