1-methyl-4-[3-(2-methylpyridin-4-yl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine

Systemtic Name: 1-methyl-4-[3-(2-methylpyridin-4-yl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine Openeye Name: 1-methyl-4-[3-(2-methyl-4-pyridyl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine CAS Name: 1-methyl-4-[3-(2-methyl-4-pyridinyl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine IUPAC Name: 1-methyl-4-[3-(2-methylpyridin-4-yl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine Traditional Name: 1-methyl-4-[3-(2-methyl-4-pyridyl)-5-(3-nitrophenyl)-1,2,4-triazol-4-yl]piperazine Formula: C19H21N7O2 MolecularWeight: 379.41574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=NN=C(N2N3CCN(CC3)C)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=CC(=C1)C2=NN=C(N2N3CCN(CC3)C)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N7O2/c1-14-12-16(6-7-20-14)19-22-21-18(15-4-3-5-17(13-15)26(27)28)25(19)24-10-8-23(2)9-11-24/h3-7,12-13H,8-11H2,1-2H3