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

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N5-(2-methylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-ethyl]-N5-(o-tolyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-2-oxoethyl]-N5-(2-methylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-2-oxoethyl]-5-N-(2-methylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-2-keto-ethyl]-N'-(o-tolyl)isothiazole-3,5-dicarboxamide Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC(C)(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC(C)(C)C)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C18H23N5O3S/c1-10-7-5-6-8-11(10)23(9-12(24)21-18(2,3)4)17(26)15-13(19)14(16(20)25)22-27-15/h5-8H,9,19H2,1-4H3,(H2,20,25)(H,21,24)