(2-methoxypyridin-3-yl)-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (2-methoxypyridin-3-yl)-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]methanone Openeye Name: (2-methoxy-3-pyridyl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (2-methoxy-3-pyridinyl)-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (2-methoxypyridin-3-yl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (2-methoxy-3-pyridyl)-[4-(5-nitrothiophene-2-carbonyl)piperazino]methanone Formula: C16H16N4O5S MolecularWeight: 376.38704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC=N1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O5S/c1-25-14-11(3-2-6-17-14)15(21)18-7-9-19(10-8-18)16(22)12-4-5-13(26-12)20(23)24/h2-6H,7-10H2,1H3