2-[4-(2-methoxyphenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-phenethyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=CN=C(C2=O)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1N2C=CN=C(C2=O)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-27-18-10-6-5-9-17(18)24-14-13-23-20(21(24)26)28-15-19(25)22-12-11-16-7-3-2-4-8-16/h2-10,13-14H,11-12,15H2,1H3,(H,22,25)