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

Systemtic Name: 1-phenyl-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Openeye Name: 1-phenyl-3-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea CAS Name: 1-phenyl-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea IUPAC Name: 1-phenyl-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Traditional Name: 1-phenyl-3-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea Formula: C16H16N6O MolecularWeight: 308.33784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCCC2=NC(=NN2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCCC2=NC(=NN2)C3=CC=NC=C3

InChI

InChI=1S/C16H16N6O/c23-16(19-13-4-2-1-3-5-13)18-11-8-14-20-15(22-21-14)12-6-9-17-10-7-12/h1-7,9-10H,8,11H2,(H2,18,19,23)(H,20,21,22)