4-butan-2-ylsulfanyl-7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 4-butan-2-ylsulfanyl-7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(4-fluorophenyl)-5-phenyl-4-sec-butylsulfanyl-pyrrolo[2,3-d]pyrimidine CAS Name: 4-(butan-2-ylthio)-7-(4-fluorophenyl)-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 4-butan-2-ylsulfanyl-7-(4-fluorophenyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(4-fluorophenyl)-5-phenyl-4-(sec-butylthio)pyrrolo[2,3-d]pyrimidine Formula: C22H20FN3S MolecularWeight: 377.477703

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCC(C)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN3S/c1-3-15(2)27-22-20-19(16-7-5-4-6-8-16)13-26(21(20)24-14-25-22)18-11-9-17(23)10-12-18/h4-15H,3H2,1-2H3