4-(3,5-dimethylphenyl)sulfanyl-3-iodanyl-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-1H-pyridin-2-one

Systemtic Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodanyl-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-1H-pyridin-2-one Openeye Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodo-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-1H-pyridin-2-one CAS Name: 4-[(3,5-dimethylphenyl)thio]-3-iodo-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-1H-pyridin-2-one IUPAC Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodo-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-1H-pyridin-2-one Traditional Name: 4-[(3,5-dimethylphenyl)thio]-3-iodo-6-methyl-5-(1,2,4-triazol-1-ylmethyl)-2-pyridone Formula: C17H17IN4OS MolecularWeight: 452.31255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=C2CN3C=NC=N3)C)I)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=C2CN3C=NC=N3)C)I)C

InChI

InChI=1S/C17H17IN4OS/c1-10-4-11(2)6-13(5-10)24-16-14(7-22-9-19-8-20-22)12(3)21-17(23)15(16)18/h4-6,8-9H,7H2,1-3H3,(H,21,23)