4-chloranyl-6-ethyl-2-methylsulfanyl-7-[(2-phenylphenyl)methyl]pyrrolo[2,3-d]pyrimidine

Systemtic Name: 4-chloranyl-6-ethyl-2-methylsulfanyl-7-[(2-phenylphenyl)methyl]pyrrolo[2,3-d]pyrimidine Openeye Name: 4-chloro-6-ethyl-2-methylsulfanyl-7-[(2-phenylphenyl)methyl]pyrrolo[2,3-d]pyrimidine CAS Name: 4-chloro-6-ethyl-2-(methylthio)-7-[(2-phenylphenyl)methyl]pyrrolo[2,3-d]pyrimidine IUPAC Name: 4-chloro-6-ethyl-2-methylsulfanyl-7-[(2-phenylphenyl)methyl]pyrrolo[2,3-d]pyrimidine Traditional Name: 4-chloro-6-ethyl-2-(methylthio)-7-(2-phenylbenzyl)pyrrolo[2,3-d]pyrimidine Formula: C22H20ClN3S MolecularWeight: 393.9323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N1CC3=CC=CC=C3C4=CC=CC=C4)N=C(N=C2Cl)SC

Isomeric SMILES

CCC1=CC2=C(N1CC3=CC=CC=C3C4=CC=CC=C4)N=C(N=C2Cl)SC

InChI

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