4-(4-tert-butylphenyl)-6-(3-methoxyphenyl)sulfanyl-pyrimidine

Systemtic Name: 4-(4-tert-butylphenyl)-6-(3-methoxyphenyl)sulfanyl-pyrimidine Openeye Name: 4-(4-tert-butylphenyl)-6-(3-methoxyphenyl)sulfanyl-pyrimidine CAS Name: 4-(4-tert-butylphenyl)-6-[(3-methoxyphenyl)thio]pyrimidine IUPAC Name: 4-(4-tert-butylphenyl)-6-(3-methoxyphenyl)sulfanylpyrimidine Traditional Name: 4-(4-tert-butylphenyl)-6-[(3-methoxyphenyl)thio]pyrimidine Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC=N2)SC3=CC=CC(=C3)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC=N2)SC3=CC=CC(=C3)OC

InChI

InChI=1S/C21H22N2OS/c1-21(2,3)16-10-8-15(9-11-16)19-13-20(23-14-22-19)25-18-7-5-6-17(12-18)24-4/h5-14H,1-4H3