4-azanyl-2-[[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[[2-(4-chlorophenyl)oxazol-4-yl]methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-(4-chlorophenyl)-4-oxazolyl]methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[[2-(4-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-(4-chlorophenyl)oxazol-4-yl]methylthio]pyrimidine-5-carbonitrile Formula: C15H10ClN5OS MolecularWeight: 343.7908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CO2)CSC3=NC=C(C(=N3)N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CO2)CSC3=NC=C(C(=N3)N)C#N)Cl

InChI

InChI=1S/C15H10ClN5OS/c16-11-3-1-9(2-4-11)14-20-12(7-22-14)8-23-15-19-6-10(5-17)13(18)21-15/h1-4,6-7H,8H2,(H2,18,19,21)