[4-(6-nitropyridin-3-yl)piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-(6-nitropyridin-3-yl)piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: [4-(6-nitro-3-pyridyl)piperazin-1-yl]-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-(6-nitro-3-pyridinyl)-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: [4-(6-nitropyridin-3-yl)piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: [4-(6-nitro-3-pyridyl)piperazino]-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C15H15N5O3S/c21-15(12-2-1-5-16-14(12)24)19-8-6-18(7-9-19)11-3-4-13(17-10-11)20(22)23/h1-5,10H,6-9H2,(H,16,24)