4-(3,5-dimethylphenyl)sulfanyl-5-(ethoxymethyl)-3-nitro-1H-pyridin-2-one

Systemtic Name: 4-(3,5-dimethylphenyl)sulfanyl-5-(ethoxymethyl)-3-nitro-1H-pyridin-2-one Openeye Name: 4-(3,5-dimethylphenyl)sulfanyl-5-(ethoxymethyl)-3-nitro-1H-pyridin-2-one CAS Name: 4-[(3,5-dimethylphenyl)thio]-5-(ethoxymethyl)-3-nitro-1H-pyridin-2-one IUPAC Name: 4-(3,5-dimethylphenyl)sulfanyl-5-(ethoxymethyl)-3-nitro-1H-pyridin-2-one Traditional Name: 4-[(3,5-dimethylphenyl)thio]-5-(ethoxymethyl)-3-nitro-2-pyridone Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CNC(=O)C(=C1SC2=CC(=CC(=C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOCC1=CNC(=O)C(=C1SC2=CC(=CC(=C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-4-22-9-12-8-17-16(19)14(18(20)21)15(12)23-13-6-10(2)5-11(3)7-13/h5-8H,4,9H2,1-3H3,(H,17,19)