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

Systemtic Name: (6-methylpyridin-3-yl)-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]methanone Openeye Name: (6-methyl-3-pyridyl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (6-methyl-3-pyridinyl)-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (6-methylpyridin-3-yl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (6-methyl-3-pyridyl)-[4-(5-nitrothiophene-2-carbonyl)piperazino]methanone Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/c1-11-2-3-12(10-17-11)15(21)18-6-8-19(9-7-18)16(22)13-4-5-14(25-13)20(23)24/h2-5,10H,6-9H2,1H3