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

Systemtic Name: 7-(3-fluorophenyl)-4-(2-methylpropylsulfanyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(3-fluorophenyl)-4-isobutylsulfanyl-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(3-fluorophenyl)-4-(2-methylpropylthio)-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(3-fluorophenyl)-4-(2-methylpropylsulfanyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(3-fluorophenyl)-4-(isobutylthio)-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C22H20FN3S MolecularWeight: 377.477703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC=NC2=C1C(=CN2C3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC(C)CSC1=NC=NC2=C1C(=CN2C3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN3S/c1-15(2)13-27-22-20-19(16-7-4-3-5-8-16)12-26(21(20)24-14-25-22)18-10-6-9-17(23)11-18/h3-12,14-15H,13H2,1-2H3