ethyl 4-[[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamoylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamoylamino]methyl]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]carbamoylamino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[[[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]amino]-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]carbamoylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[4-methyl-2-(4-methylpiperazino)-6-quinolyl]carbamoylamino]methyl]cyclohexanecarboxylic acid ethyl ester Formula: C26H37N5O3 MolecularWeight: 467.60368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CNC(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CNC(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C

InChI

InChI=1S/C26H37N5O3/c1-4-34-25(32)20-7-5-19(6-8-20)17-27-26(33)28-21-9-10-23-22(16-21)18(2)15-24(29-23)31-13-11-30(3)12-14-31/h9-10,15-16,19-20H,4-8,11-14,17H2,1-3H3,(H2,27,28,33)