4-azanyl-N5-[(1S)-2-(tert-butylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-N5-cyclohexyl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(1S)-2-(tert-butylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]-N5-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1S)-2-(tert-butylamino)-2-oxo-1-(p-tolyl)ethyl]-N5-cyclohexyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(1S)-2-(tert-butylamino)-1-(4-methylphenyl)-2-oxoethyl]-N5-cyclohexylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(1S)-2-(tert-butylamino)-1-(4-methylphenyl)-2-oxoethyl]-5-N-cyclohexyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1S)-2-(tert-butylamino)-2-keto-1-(p-tolyl)ethyl]-N'-cyclohexyl-isothiazole-3,5-dicarboxamide Formula: C24H33N5O3S MolecularWeight: 471.61552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)NC(C)(C)C)N(C2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C(=O)NC(C)(C)C)N(C2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C24H33N5O3S/c1-14-10-12-15(13-11-14)19(22(31)27-24(2,3)4)29(16-8-6-5-7-9-16)23(32)20-17(25)18(21(26)30)28-33-20/h10-13,16,19H,5-9,25H2,1-4H3,(H2,26,30)(H,27,31)/t19-/m0/s1