1-methyl-3-nitro-4-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]quinolin-2-one

Systemtic Name: 1-methyl-3-nitro-4-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]quinolin-2-one Openeye Name: 1-methyl-3-nitro-4-[4-[2-(2-thienyl)acetyl]piperazin-1-yl]quinolin-2-one CAS Name: 1-methyl-3-nitro-4-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-2-quinolinone IUPAC Name: 1-methyl-3-nitro-4-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]quinolin-2-one Traditional Name: 1-methyl-3-nitro-4-[4-[2-(2-thienyl)acetyl]piperazino]carbostyril Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)CC4=CC=CS4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C20H20N4O4S/c1-21-16-7-3-2-6-15(16)18(19(20(21)26)24(27)28)23-10-8-22(9-11-23)17(25)13-14-5-4-12-29-14/h2-7,12H,8-11,13H2,1H3