2-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-6-[(E)-2-phenylethenyl]pyrimidine

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-6-[(E)-2-phenylethenyl]pyrimidine Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-6-[(E)-styryl]pyrimidine CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-4-methyl-6-[(E)-2-phenylethenyl]pyrimidine IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-6-[(E)-2-phenylethenyl]pyrimidine Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-4-methyl-6-[(E)-styryl]pyrimidine Formula: C22H22N2S MolecularWeight: 346.48848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=CC(=N2)C)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=CC(=N2)C)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H22N2S/c1-16-9-10-17(2)20(13-16)15-25-22-23-18(3)14-21(24-22)12-11-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3/b12-11+