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

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N5-(3-methoxyphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-1-(6-quinolyl)ethyl]-N5-(3-methoxyphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-1-(6-quinolinyl)ethyl]-N5-(3-methoxyphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-2-oxo-1-quinolin-6-ylethyl]-5-N-(3-methoxyphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-2-keto-1-(6-quinolyl)ethyl]-N'-(3-methoxyphenyl)isothiazole-3,5-dicarboxamide Formula: C27H28N6O4S MolecularWeight: 532.61402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(C3=CC(=CC=C3)OC)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(C3=CC(=CC=C3)OC)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C27H28N6O4S/c1-27(2,3)31-25(35)22(16-10-11-19-15(13-16)7-6-12-30-19)33(17-8-5-9-18(14-17)37-4)26(36)23-20(28)21(24(29)34)32-38-23/h5-14,22H,28H2,1-4H3,(H2,29,34)(H,31,35)