N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide Openeye Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide CAS Name: N-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide Traditional Name: N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)N3CCC4(CC3)OCCO4)N5CCN(CC5)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)N3CCC4(CC3)OCCO4)N5CCN(CC5)C

InChI

InChI=1S/C23H31N5O2S/c1-17-15-21(27-11-9-26(2)10-12-27)25-20-4-3-18(16-19(17)20)24-22(31)28-7-5-23(6-8-28)29-13-14-30-23/h3-4,15-16H,5-14H2,1-2H3,(H,24,31)