5-[(4-iodanyl-2-methyl-phenyl)amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-[(4-iodanyl-2-methyl-phenyl)amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile Openeye Name: 5-(4-iodo-2-methyl-anilino)-3-oxo-isothiazole-4-carbonitrile CAS Name: 5-(4-iodo-2-methylanilino)-3-oxo-4-isothiazolecarbonitrile IUPAC Name: 5-(4-iodo-2-methylanilino)-3-oxo-1,2-thiazole-4-carbonitrile Traditional Name: 5-(4-iodo-2-methyl-anilino)-3-keto-4-isothiazoline-4-carbonitrile Formula: C11H8IN3OS MolecularWeight: 357.17019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C(=O)NS2)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C(=O)NS2)C#N

InChI

InChI=1S/C11H8IN3OS/c1-6-4-7(12)2-3-9(6)14-11-8(5-13)10(16)15-17-11/h2-4,14H,1H3,(H,15,16)