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

Systemtic Name: 7-(4-methoxyphenyl)-4-(2-methylpropylsulfanyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 4-isobutylsulfanyl-7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(4-methoxyphenyl)-4-(2-methylpropylthio)-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(4-methoxyphenyl)-4-(2-methylpropylsulfanyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 4-(isobutylthio)-7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C23H23N3OS MolecularWeight: 389.51322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3OS/c1-16(2)14-28-23-21-20(17-7-5-4-6-8-17)13-26(22(21)24-15-25-23)18-9-11-19(27-3)12-10-18/h4-13,15-16H,14H2,1-3H3