1-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]pent-4-yn-1-one

Systemtic Name: 1-[2-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonyl]pyrazolidin-1-yl]pent-4-yn-1-one Openeye Name: 1-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one CAS Name: 1-[2-[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]-1-pyrazolidinyl]-4-pentyn-1-one IUPAC Name: 1-[2-(5-methyl-2-phenyltriazole-4-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one Traditional Name: 1-[2-(5-methyl-2-phenyl-triazole-4-carbonyl)pyrazolidin-1-yl]pent-4-yn-1-one Formula: C18H19N5O2 MolecularWeight: 337.37576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CCC#C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN2C(=O)CCC#C)C3=CC=CC=C3

InChI

InChI=1S/C18H19N5O2/c1-3-4-11-16(24)21-12-8-13-22(21)18(25)17-14(2)19-23(20-17)15-9-6-5-7-10-15/h1,5-7,9-10H,4,8,11-13H2,2H3