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

Systemtic Name: N-(2,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)-3-oxo-pyrazin-2-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[4-(4-methoxyphenyl)-3-oxo-2-pyrazinyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[4-(4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[3-keto-4-(4-methoxyphenyl)pyrazin-2-yl]thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3S/c1-14-4-5-15(2)18(12-14)23-19(25)13-28-20-21(26)24(11-10-22-20)16-6-8-17(27-3)9-7-16/h4-12H,13H2,1-3H3,(H,23,25)