2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-one

Systemtic Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-one Openeye Name: 4-allyl-2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-5-(3-pyridyl)-1,2,4-triazol-3-one CAS Name: 2-[2-[4-(2,3-dimethylphenyl)-1-piperazinyl]ethyl]-4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-one IUPAC Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-one Traditional Name: 4-allyl-2-[2-[4-(2,3-dimethylphenyl)piperazino]ethyl]-5-(3-pyridyl)-1,2,4-triazol-3-one Formula: C24H30N6O MolecularWeight: 418.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CCN3C(=O)N(C(=N3)C4=CN=CC=C4)CC=C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CCN3C(=O)N(C(=N3)C4=CN=CC=C4)CC=C)C

InChI

InChI=1S/C24H30N6O/c1-4-11-29-23(21-8-6-10-25-18-21)26-30(24(29)31)17-14-27-12-15-28(16-13-27)22-9-5-7-19(2)20(22)3/h4-10,18H,1,11-17H2,2-3H3