5-[(4-iodophenyl)amino]-3-oxidanylidene-N'-(1-oxidanylpropan-2-yl)-1,2-thiazole-4-carboximidamide

Systemtic Name: 5-[(4-iodophenyl)amino]-3-oxidanylidene-N'-(1-oxidanylpropan-2-yl)-1,2-thiazole-4-carboximidamide Openeye Name: N'-(2-hydroxy-1-methyl-ethyl)-5-(4-iodoanilino)-3-oxo-isothiazole-4-carboxamidine CAS Name: N'-(1-hydroxypropan-2-yl)-5-(4-iodoanilino)-3-oxo-4-isothiazolecarboximidamide IUPAC Name: N'-(1-hydroxypropan-2-yl)-5-(4-iodoanilino)-3-oxo-1,2-thiazole-4-carboximidamide Traditional Name: N'-(2-hydroxy-1-methyl-ethyl)-5-(4-iodoanilino)-3-keto-4-isothiazoline-4-carboxamidine Formula: C13H15IN4O2S MolecularWeight: 418.25327

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)N=C(C1=C(SNC1=O)NC2=CC=C(C=C2)I)N

Isomeric SMILES

CC(CO)N=C(C1=C(SNC1=O)NC2=CC=C(C=C2)I)N

InChI

InChI=1S/C13H15IN4O2S/c1-7(6-19)16-11(15)10-12(20)18-21-13(10)17-9-4-2-8(14)3-5-9/h2-5,7,17,19H,6H2,1H3,(H2,15,16)(H,18,20)