N-(3,4-dimethoxyphenyl)-2-[4-(3-methylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-(3-methylphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-(m-tolyl)-3-oxo-pyrazin-2-yl]sulfanyl-acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[4-(3-methylphenyl)-3-oxo-2-pyrazinyl]thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-(3-methylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[3-keto-4-(m-tolyl)pyrazin-2-yl]thio]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4S/c1-14-5-4-6-16(11-14)24-10-9-22-20(21(24)26)29-13-19(25)23-15-7-8-17(27-2)18(12-15)28-3/h4-12H,13H2,1-3H3,(H,23,25)