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

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-1-thiophen-2-yl-ethyl]-N5-(3-hydroxyphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-1-(2-thienyl)ethyl]-N5-(3-hydroxyphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-1-thiophen-2-ylethyl]-N5-(3-hydroxyphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-2-oxo-1-thiophen-2-ylethyl]-5-N-(3-hydroxyphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-2-keto-1-(2-thienyl)ethyl]-N'-(3-hydroxyphenyl)isothiazole-3,5-dicarboxamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CS1)N(C2=CC(=CC=C2)O)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=CS1)N(C2=CC(=CC=C2)O)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C21H23N5O4S2/c1-21(2,3)24-19(29)16(13-8-5-9-31-13)26(11-6-4-7-12(27)10-11)20(30)17-14(22)15(18(23)28)25-32-17/h4-10,16,27H,22H2,1-3H3,(H2,23,28)(H,24,29)