N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C25H31N7S MolecularWeight: 461.62554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)N3CCN(CC3)C4=CC=CC=N4)N5CCN(CC5)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)N3CCN(CC3)C4=CC=CC=N4)N5CCN(CC5)C

InChI

InChI=1S/C25H31N7S/c1-19-17-24(31-11-9-29(2)10-12-31)28-22-7-6-20(18-21(19)22)27-25(33)32-15-13-30(14-16-32)23-5-3-4-8-26-23/h3-8,17-18H,9-16H2,1-2H3,(H,27,33)