1-(3-ethanoylphenyl)-3-[1-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[1-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Openeye Name: 1-(3-acetylphenyl)-3-[1-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea CAS Name: 1-(3-acetylphenyl)-3-[1-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea IUPAC Name: 1-(3-acetylphenyl)-3-[1-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Traditional Name: 1-(3-acetylphenyl)-3-[1-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NN1)C2=CC=NC=C2)NC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC(C1=NC(=NN1)C2=CC=NC=C2)NC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C18H18N6O2/c1-11(16-22-17(24-23-16)13-6-8-19-9-7-13)20-18(26)21-15-5-3-4-14(10-15)12(2)25/h3-11H,1-2H3,(H2,20,21,26)(H,22,23,24)