ethyl 6-azanyl-1-methyl-4-oxidanylidene-7-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinoline-3-carboxylate

Systemtic Name: ethyl 6-azanyl-1-methyl-4-oxidanylidene-7-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinoline-3-carboxylate Openeye Name: ethyl 6-amino-1-methyl-4-oxo-7-(4-thiazol-2-ylpiperazin-1-yl)quinoline-3-carboxylate CAS Name: 6-amino-1-methyl-4-oxo-7-[4-(2-thiazolyl)-1-piperazinyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-1-methyl-4-oxo-7-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinoline-3-carboxylate Traditional Name: 6-amino-4-keto-1-methyl-7-(4-thiazol-2-ylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=NC=CS4)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=NC=CS4)C

InChI

InChI=1S/C20H23N5O3S/c1-3-28-19(27)14-12-23(2)16-11-17(15(21)10-13(16)18(14)26)24-5-7-25(8-6-24)20-22-4-9-29-20/h4,9-12H,3,5-8,21H2,1-2H3