7-(3-chloranyl-4-methyl-phenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(3-chloranyl-4-methyl-phenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(3-chloro-4-methyl-phenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(3-chloro-4-methylphenyl)-5-phenyl-4-(propylthio)pyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(3-chloro-4-methylphenyl)-5-phenyl-4-propylsulfanylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(3-chloro-4-methyl-phenyl)-5-phenyl-4-(propylthio)pyrrolo[2,3-d]pyrimidine Formula: C22H20ClN3S MolecularWeight: 393.9323

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=NC2=C1C(=CN2C3=CC(=C(C=C3)C)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCSC1=NC=NC2=C1C(=CN2C3=CC(=C(C=C3)C)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3S/c1-3-11-27-22-20-18(16-7-5-4-6-8-16)13-26(21(20)24-14-25-22)17-10-9-15(2)19(23)12-17/h4-10,12-14H,3,11H2,1-2H3