N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]-4-piperidin-1-yl-piperidine-1-carbothioamide

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]-4-piperidin-1-yl-piperidine-1-carbothioamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]-4-(1-piperidyl)piperidine-1-carbothioamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]-4-(1-piperidinyl)-1-piperidinecarbothioamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]-4-piperidin-1-ylpiperidine-1-carbothioamide Traditional Name: N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]-4-piperidino-piperidine-1-carbothioamide Formula: C27H40N6S MolecularWeight: 480.7117

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)N4CCC(CC4)N5CCCCC5)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)N4CCC(CC4)N5CCCCC5)C(=C2)C

InChI

InChI=1S/C27H40N6S/c1-3-30-15-17-32(18-16-30)26-19-21(2)24-20-22(7-8-25(24)29-26)28-27(34)33-13-9-23(10-14-33)31-11-5-4-6-12-31/h7-8,19-20,23H,3-6,9-18H2,1-2H3,(H,28,34)