4-azanyl-N5-(4-cyclohexylphenyl)-N5-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(4-cyclohexylphenyl)-N5-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(4-cyclohexylphenyl)-N5-[2-(1,1-dimethylpropylamino)-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(4-cyclohexylphenyl)-N5-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(4-cyclohexylphenyl)-5-N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-amylamino)-2-keto-ethyl]-N'-(4-cyclohexylphenyl)isothiazole-3,5-dicarboxamide Formula: C24H33N5O3S MolecularWeight: 471.61552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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