2-[[7-chloranyl-2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[7-chloranyl-2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]ethanamide Openeye Name: 2-[[7-chloro-2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetamide CAS Name: 2-[[7-chloro-2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]thio]acetamide IUPAC Name: 2-[[7-chloro-2-(4-ethoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl]acetamide Traditional Name: 2-[(7-chloro-2-p-phenetyl-5H-chromeno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C=CC(=C4)Cl)C(=N2)SCC(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C=CC(=C4)Cl)C(=N2)SCC(=O)N

InChI

InChI=1S/C21H18ClN3O3S/c1-2-27-15-6-3-12(4-7-15)19-24-20-16(21(25-19)29-11-18(23)26)10-13-9-14(22)5-8-17(13)28-20/h3-9H,2,10-11H2,1H3,(H2,23,26)