N-(3-chloranyl-4-fluoranyl-phenyl)-7-(2-methoxyethoxy)-6-methylsulfanyl-pyrido[3,2-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-7-(2-methoxyethoxy)-6-methylsulfanyl-pyrido[3,2-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-7-(2-methoxyethoxy)-6-methylsulfanyl-pyrido[3,2-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-7-(2-methoxyethoxy)-6-(methylthio)-4-pyrido[3,2-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-7-(2-methoxyethoxy)-6-methylsulfanylpyrido[3,2-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[7-(2-methoxyethoxy)-6-(methylthio)pyrido[3,2-d]pyrimidin-4-yl]amine Formula: C17H16ClFN4O2S MolecularWeight: 394.850943

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(N=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)SC

Isomeric SMILES

COCCOC1=C(N=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)SC

InChI

InChI=1S/C17H16ClFN4O2S/c1-24-5-6-25-14-8-13-15(23-17(14)26-2)16(21-9-20-13)22-10-3-4-12(19)11(18)7-10/h3-4,7-9H,5-6H2,1-2H3,(H,20,21,22)