4-azanyl-N5-(4-butoxyphenyl)-N5-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(4-butoxyphenyl)-N5-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(4-butoxyphenyl)-N5-[(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(4-butoxyphenyl)-N5-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(4-butoxyphenyl)-5-N-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(4-butoxyphenyl)-N'-[(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]isothiazole-3,5-dicarboxamide Formula: C24H33N5O4S MolecularWeight: 487.61492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(C(C)C(=O)NC2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N([C@H](C)C(=O)NC2CCCCC2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C24H33N5O4S/c1-3-4-14-33-18-12-10-17(11-13-18)29(15(2)23(31)27-16-8-6-5-7-9-16)24(32)21-19(25)20(22(26)30)28-34-21/h10-13,15-16H,3-9,14,25H2,1-2H3,(H2,26,30)(H,27,31)/t15-/m1/s1