2-methylsulfanyl-4-(4-propan-2-ylphenoxy)-6-(1,2,4-triazol-1-yl)pyrimidine

Systemtic Name: 2-methylsulfanyl-4-(4-propan-2-ylphenoxy)-6-(1,2,4-triazol-1-yl)pyrimidine Openeye Name: 4-(4-isopropylphenoxy)-2-methylsulfanyl-6-(1,2,4-triazol-1-yl)pyrimidine CAS Name: 2-(methylthio)-4-(4-propan-2-ylphenoxy)-6-(1,2,4-triazol-1-yl)pyrimidine IUPAC Name: 2-methylsulfanyl-4-(4-propan-2-ylphenoxy)-6-(1,2,4-triazol-1-yl)pyrimidine Traditional Name: 4-(4-isopropylphenoxy)-2-(methylthio)-6-(1,2,4-triazol-1-yl)pyrimidine Formula: C16H17N5OS MolecularWeight: 327.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C=NC=N3)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC(=NC(=C2)N3C=NC=N3)SC

InChI

InChI=1S/C16H17N5OS/c1-11(2)12-4-6-13(7-5-12)22-15-8-14(19-16(20-15)23-3)21-10-17-9-18-21/h4-11H,1-3H3