2-[(3R)-3-(3-methylphenyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine

Systemtic Name: 2-[(3R)-3-(3-methylphenyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine Openeye Name: 2-[(3R)-3-(m-tolyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine CAS Name: 2-[(3R)-3-(3-methylphenyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine IUPAC Name: 2-[(3R)-3-(3-methylphenyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine Traditional Name: 2-[(3R)-3-(m-tolyl)-2,3-dihydro-1H-1,2,4-triazol-5-yl]pyrazine Formula: C13H13N5 MolecularWeight: 239.27582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2NNC(=N2)C3=NC=CN=C3

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2NNC(=N2)C3=NC=CN=C3

InChI

InChI=1S/C13H13N5/c1-9-3-2-4-10(7-9)12-16-13(18-17-12)11-8-14-5-6-15-11/h2-8,12,17H,1H3,(H,16,18)/t12-/m1/s1