ethyl 1-methyl-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,8-naphthyridine-3-carboxylate

Systemtic Name: ethyl 1-methyl-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,8-naphthyridine-3-carboxylate Openeye Name: ethyl 1-methyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylate CAS Name: 1-methyl-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1,8-naphthyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carboxylate Traditional Name: 2-keto-1-methyl-4-[4-(2-thenoyl)piperazino]-1,8-naphthyridine-3-carboxylic acid ethyl ester Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4S/c1-3-29-21(28)16-17(14-6-4-8-22-18(14)23(2)20(16)27)24-9-11-25(12-10-24)19(26)15-7-5-13-30-15/h4-8,13H,3,9-12H2,1-2H3