2-(4-chlorophenyl)-4-(phenylmethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine

Systemtic Name: 2-(4-chlorophenyl)-4-(phenylmethylsulfanyl)-5H-chromeno[2,3-d]pyrimidine Openeye Name: 4-benzylsulfanyl-2-(4-chlorophenyl)-5H-chromeno[2,3-d]pyrimidine CAS Name: 2-(4-chlorophenyl)-4-(phenylmethylthio)-5H-[1]benzopyrano[2,3-d]pyrimidine IUPAC Name: 4-benzylsulfanyl-2-(4-chlorophenyl)-5H-chromeno[2,3-d]pyrimidine Traditional Name: 4-(benzylthio)-2-(4-chlorophenyl)-5H-chromeno[2,3-d]pyrimidine Formula: C24H17ClN2OS MolecularWeight: 416.92258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C1C(=NC(=N3)C4=CC=C(C=C4)Cl)SCC5=CC=CC=C5

Isomeric SMILES

C1C2=CC=CC=C2OC3=C1C(=NC(=N3)C4=CC=C(C=C4)Cl)SCC5=CC=CC=C5

InChI

InChI=1S/C24H17ClN2OS/c25-19-12-10-17(11-13-19)22-26-23-20(14-18-8-4-5-9-21(18)28-23)24(27-22)29-15-16-6-2-1-3-7-16/h1-13H,14-15H2