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

Systemtic Name: 2-[4-(3,5-dimethylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[4-(3,5-dimethylphenyl)-3-oxo-pyrazin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[4-(3,5-dimethylphenyl)-3-oxo-2-pyrazinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[4-(3,5-dimethylphenyl)-3-keto-pyrazin-2-yl]thio]-N-phenethyl-acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3O2S/c1-16-12-17(2)14-19(13-16)25-11-10-24-21(22(25)27)28-15-20(26)23-9-8-18-6-4-3-5-7-18/h3-7,10-14H,8-9,15H2,1-2H3,(H,23,26)