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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CN(C2=O)C3=CC(=C(C=C3)C)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CN(C2=O)C3=CC(=C(C=C3)C)Cl)C

InChI

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