2-[4-(3-chloranyl-4-methoxy-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(3-chloranyl-4-methoxy-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(3-chloro-4-methoxy-phenyl)-3-oxo-pyrazin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-(3-chloro-4-methoxyphenyl)-3-oxo-2-pyrazinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(3-chloro-4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[4-(3-chloro-4-methoxy-phenyl)-3-keto-pyrazin-2-yl]thio]acetamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NCC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H18ClN3O3S/c1-27-17-8-7-15(11-16(17)21)24-10-9-22-19(20(24)26)28-13-18(25)23-12-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3,(H,23,25)