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

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N5-[(4-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-ethyl]-N5-[(4-methoxyphenyl)methyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-2-oxoethyl]-N5-[(4-methoxyphenyl)methyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-2-oxoethyl]-5-N-[(4-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-2-keto-ethyl]-N'-p-anisyl-isothiazole-3,5-dicarboxamide Formula: C19H25N5O4S MolecularWeight: 419.4979

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(CC1=CC=C(C=C1)OC)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC(C)(C)NC(=O)CN(CC1=CC=C(C=C1)OC)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C19H25N5O4S/c1-19(2,3)22-13(25)10-24(9-11-5-7-12(28-4)8-6-11)18(27)16-14(20)15(17(21)26)23-29-16/h5-8H,9-10,20H2,1-4H3,(H2,21,26)(H,22,25)