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

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]morpholine-4-carbothioamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]morpholine-4-carbothioamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]-4-morpholinecarbothioamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]morpholine-4-carbothioamide Traditional Name: N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]morpholine-4-carbothioamide Formula: C21H29N5OS MolecularWeight: 399.55286

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)N4CCOCC4)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)N4CCOCC4)C(=C2)C

InChI

InChI=1S/C21H29N5OS/c1-3-24-6-8-25(9-7-24)20-14-16(2)18-15-17(4-5-19(18)23-20)22-21(28)26-10-12-27-13-11-26/h4-5,14-15H,3,6-13H2,1-2H3,(H,22,28)