ethyl 4-[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[[[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]amino]-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[[4-methyl-2-(4-methylpiperazino)-6-quinolyl]thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C24H34N6O2S MolecularWeight: 470.63076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

InChI

InChI=1S/C24H34N6O2S/c1-4-32-24(31)30-9-7-18(8-10-30)25-23(33)26-19-5-6-21-20(16-19)17(2)15-22(27-21)29-13-11-28(3)12-14-29/h5-6,15-16,18H,4,7-14H2,1-3H3,(H2,25,26,33)