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

Systemtic Name: 7-(4-bromophenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(4-bromophenyl)-5-phenyl-4-propylsulfanyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(4-bromophenyl)-5-phenyl-4-(propylthio)pyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(4-bromophenyl)-5-phenyl-4-propylsulfanylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(4-bromophenyl)-5-phenyl-4-(propylthio)pyrrolo[2,3-d]pyrimidine Formula: C21H18BrN3S MolecularWeight: 424.35672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrN3S/c1-2-12-26-21-19-18(15-6-4-3-5-7-15)13-25(20(19)23-14-24-21)17-10-8-16(22)9-11-17/h3-11,13-14H,2,12H2,1H3