4-azanyl-N5-(4-butoxyphenyl)-N5-[(2R)-1-(tert-butylamino)-1-oxidanylidene-butan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(4-butoxyphenyl)-N5-[(2R)-1-(tert-butylamino)-1-oxidanylidene-butan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(4-butoxyphenyl)-N5-[(1R)-1-(tert-butylcarbamoyl)propyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(4-butoxyphenyl)-N5-[(2R)-1-(tert-butylamino)-1-oxobutan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(4-butoxyphenyl)-5-N-[(2R)-1-(tert-butylamino)-1-oxobutan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(4-butoxyphenyl)-N'-[(1R)-1-(tert-butylcarbamoyl)propyl]isothiazole-3,5-dicarboxamide Formula: C23H33N5O4S MolecularWeight: 475.60422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(C(CC)C(=O)NC(C)(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N([C@H](CC)C(=O)NC(C)(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C23H33N5O4S/c1-6-8-13-32-15-11-9-14(10-12-15)28(16(7-2)21(30)26-23(3,4)5)22(31)19-17(24)18(20(25)29)27-33-19/h9-12,16H,6-8,13,24H2,1-5H3,(H2,25,29)(H,26,30)/t16-/m1/s1