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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Openeye Name: 1-(3-chlorophenyl)-3-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea CAS Name: 1-(3-chlorophenyl)-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea Formula: C16H15ClN6O MolecularWeight: 342.7829

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN6O/c17-12-2-1-3-13(10-12)20-16(24)19-9-6-14-21-15(23-22-14)11-4-7-18-8-5-11/h1-5,7-8,10H,6,9H2,(H2,19,20,24)(H,21,22,23)