2-[4-(2,2-dimethylpropoxy)phenyl]sulfanyl-4,5-dimethyl-pyrimidine

Systemtic Name: 2-[4-(2,2-dimethylpropoxy)phenyl]sulfanyl-4,5-dimethyl-pyrimidine Openeye Name: 2-[4-(2,2-dimethylpropoxy)phenyl]sulfanyl-4,5-dimethyl-pyrimidine CAS Name: 2-[[4-(2,2-dimethylpropoxy)phenyl]thio]-4,5-dimethylpyrimidine IUPAC Name: 2-[4-(2,2-dimethylpropoxy)phenyl]sulfanyl-4,5-dimethylpyrimidine Traditional Name: 4,5-dimethyl-2-[(4-neopentyloxyphenyl)thio]pyrimidine Formula: C17H22N2OS MolecularWeight: 302.43438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C)SC2=CC=C(C=C2)OCC(C)(C)C

Isomeric SMILES

CC1=CN=C(N=C1C)SC2=CC=C(C=C2)OCC(C)(C)C

InChI

InChI=1S/C17H22N2OS/c1-12-10-18-16(19-13(12)2)21-15-8-6-14(7-9-15)20-11-17(3,4)5/h6-10H,11H2,1-5H3