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

Systemtic Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodanyl-6-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyridin-2-one Openeye Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodo-6-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyridin-2-one CAS Name: 4-[(3,5-dimethylphenyl)thio]-3-iodo-6-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyridin-2-one IUPAC Name: 4-(3,5-dimethylphenyl)sulfanyl-3-iodo-6-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyridin-2-one Traditional Name: 4-[(3,5-dimethylphenyl)thio]-3-iodo-6-methyl-5-(1H-pyrrol-2-ylmethyl)-2-pyridone Formula: C19H19IN2OS MolecularWeight: 450.33643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=C2CC3=CC=CN3)C)I)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(C(=O)NC(=C2CC3=CC=CN3)C)I)C

InChI

InChI=1S/C19H19IN2OS/c1-11-7-12(2)9-15(8-11)24-18-16(10-14-5-4-6-21-14)13(3)22-19(23)17(18)20/h4-9,21H,10H2,1-3H3,(H,22,23)