4-azanyl-N5-[2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N5-phenyl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N5-phenyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(cyclohexylamino)-2-oxo-1-(6-quinolyl)ethyl]-N5-phenyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(cyclohexylamino)-2-oxo-1-(6-quinolinyl)ethyl]-N5-phenylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(cyclohexylamino)-2-oxo-1-quinolin-6-ylethyl]-5-N-phenyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclohexylamino)-2-keto-1-(6-quinolyl)ethyl]-N'-phenyl-isothiazole-3,5-dicarboxamide Formula: C28H28N6O3S MolecularWeight: 528.62532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2)N=CC=C3)N(C4=CC=CC=C4)C(=O)C5=C(C(=NS5)C(=O)N)N

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2)N=CC=C3)N(C4=CC=CC=C4)C(=O)C5=C(C(=NS5)C(=O)N)N

InChI

InChI=1S/C28H28N6O3S/c29-22-23(26(30)35)33-38-25(22)28(37)34(20-11-5-2-6-12-20)24(27(36)32-19-9-3-1-4-10-19)18-13-14-21-17(16-18)8-7-15-31-21/h2,5-8,11-16,19,24H,1,3-4,9-10,29H2,(H2,30,35)(H,32,36)