1,6-dimethyl-3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-2-one

Systemtic Name: 1,6-dimethyl-3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-2-one Openeye Name: 1,6-dimethyl-3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinolin-2-one CAS Name: 1,6-dimethyl-3-nitro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-quinolinone IUPAC Name: 1,6-dimethyl-3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinolin-2-one Traditional Name: 1,6-dimethyl-3-nitro-4-[4-(2-thenoyl)piperazino]carbostyril Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O4S/c1-13-5-6-15-14(12-13)17(18(24(27)28)20(26)21(15)2)22-7-9-23(10-8-22)19(25)16-4-3-11-29-16/h3-6,11-12H,7-10H2,1-2H3