1-(cyclopropylmethyl)-3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-2-one

Systemtic Name: 1-(cyclopropylmethyl)-3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinolin-2-one Openeye Name: 1-(cyclopropylmethyl)-3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinolin-2-one CAS Name: 1-(cyclopropylmethyl)-3-nitro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-quinolinone IUPAC Name: 1-(cyclopropylmethyl)-3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinolin-2-one Traditional Name: 1-(cyclopropylmethyl)-3-nitro-4-[4-(2-thenoyl)piperazino]carbostyril Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=CC=CC=C3C(=C(C2=O)[N+](=O)[O-])N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CC1CN2C3=CC=CC=C3C(=C(C2=O)[N+](=O)[O-])N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C22H22N4O4S/c27-21(18-6-3-13-31-18)24-11-9-23(10-12-24)19-16-4-1-2-5-17(16)25(14-15-7-8-15)22(28)20(19)26(29)30/h1-6,13,15H,7-12,14H2