N-(1-benzothiophen-2-yl)-2-[1-(4-methoxyphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-benzothiophen-2-yl)-2-[1-(4-methoxyphenyl)-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(benzothiophen-2-yl)-2-[6-hydroxy-1-(4-methoxyphenyl)-4-oxo-pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(1-benzothiophen-2-yl)-2-[[6-hydroxy-1-(4-methoxyphenyl)-4-oxo-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(1-benzothiophen-2-yl)-2-[6-hydroxy-1-(4-methoxyphenyl)-4-oxopyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(benzothiophen-2-yl)-2-[[6-hydroxy-4-keto-1-(4-methoxyphenyl)pyrimidin-2-yl]thio]acetamide Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC4=CC=CC=C4S3)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC4=CC=CC=C4S3)O

InChI

InChI=1S/C21H17N3O4S2/c1-28-15-8-6-14(7-9-15)24-20(27)11-17(25)23-21(24)29-12-18(26)22-19-10-13-4-2-3-5-16(13)30-19/h2-11,27H,12H2,1H3,(H,22,26)