4-azanyl-N5-[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-N5-quinolin-3-yl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-N5-quinolin-3-yl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclopentylamino)-1-methyl-2-oxo-ethyl]-N5-(3-quinolyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N5-(3-quinolinyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[1-(cyclopentylamino)-1-oxopropan-2-yl]-5-N-quinolin-3-yl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclopentylamino)-2-keto-1-methyl-ethyl]-N'-(3-quinolyl)isothiazole-3,5-dicarboxamide Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)N(C2=CC3=CC=CC=C3N=C2)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

CC(C(=O)NC1CCCC1)N(C2=CC3=CC=CC=C3N=C2)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C22H24N6O3S/c1-12(21(30)26-14-7-3-4-8-14)28(15-10-13-6-2-5-9-16(13)25-11-15)22(31)19-17(23)18(20(24)29)27-32-19/h2,5-6,9-12,14H,3-4,7-8,23H2,1H3,(H2,24,29)(H,26,30)