2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine Formula: C19H14ClFN2S2 MolecularWeight: 388.909263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C19H14ClFN2S2/c1-11-5-6-17-13(7-11)18-12(9-24-17)8-22-19(23-18)25-10-14-15(20)3-2-4-16(14)21/h2-8H,9-10H2,1H3