2-tert-butyl-5-[2-(3-methylphenyl)ethynyl]pyrimidine

Systemtic Name: 2-tert-butyl-5-[2-(3-methylphenyl)ethynyl]pyrimidine Openeye Name: 2-tert-butyl-5-[2-(m-tolyl)ethynyl]pyrimidine CAS Name: 2-tert-butyl-5-[2-(3-methylphenyl)ethynyl]pyrimidine IUPAC Name: 2-tert-butyl-5-[2-(3-methylphenyl)ethynyl]pyrimidine Traditional Name: 2-tert-butyl-5-[2-(m-tolyl)ethynyl]pyrimidine Formula: C17H18N2 MolecularWeight: 250.33822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C#CC2=CN=C(N=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C#CC2=CN=C(N=C2)C(C)(C)C

InChI

InChI=1S/C17H18N2/c1-13-6-5-7-14(10-13)8-9-15-11-18-16(19-12-15)17(2,3)4/h5-7,10-12H,1-4H3