4-azanyl-N5-[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N5-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]-N5-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-benzyl-N5-[2-(tert-butylamino)-1-methyl-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-(tert-butylamino)-1-oxopropan-2-yl]-N5-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-benzyl-5-N-[1-(tert-butylamino)-1-oxopropan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-benzyl-N'-[2-(tert-butylamino)-2-keto-1-methyl-ethyl]isothiazole-3,5-dicarboxamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O3S/c1-11(17(26)22-19(2,3)4)24(10-12-8-6-5-7-9-12)18(27)15-13(20)14(16(21)25)23-28-15/h5-9,11H,10,20H2,1-4H3,(H2,21,25)(H,22,26)