ethyl 1-[3-(dimethylamino)propyl]-6-methyl-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxylate

Systemtic Name: ethyl 1-[3-(dimethylamino)propyl]-6-methyl-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxylate Openeye Name: ethyl 1-[3-(dimethylamino)propyl]-6-methyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carboxylate CAS Name: 1-[3-(dimethylamino)propyl]-6-methyl-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(dimethylamino)propyl]-6-methyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carboxylate Traditional Name: 1-[3-(dimethylamino)propyl]-2-keto-6-methyl-4-[4-(2-thenoyl)piperazino]quinoline-3-carboxylic acid ethyl ester Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O4S/c1-5-35-27(34)23-24(29-13-15-30(16-14-29)25(32)22-8-6-17-36-22)20-18-19(2)9-10-21(20)31(26(23)33)12-7-11-28(3)4/h6,8-10,17-18H,5,7,11-16H2,1-4H3