2-[4-(3-chloranyl-4-methyl-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-[4-(3-chloro-4-methyl-phenyl)-3-oxo-pyrazin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-[[4-(3-chloro-4-methylphenyl)-3-oxo-2-pyrazinyl]thio]-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-[4-(3-chloro-4-methylphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-[[4-(3-chloro-4-methyl-phenyl)-3-keto-pyrazin-2-yl]thio]-N-(3,5-dimethylphenyl)acetamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NC3=CC(=CC(=C3)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NC3=CC(=CC(=C3)C)C)Cl

InChI

InChI=1S/C21H20ClN3O2S/c1-13-8-14(2)10-16(9-13)24-19(26)12-28-20-21(27)25(7-6-23-20)17-5-4-15(3)18(22)11-17/h4-11H,12H2,1-3H3,(H,24,26)