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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NCC2=NC(=NN2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NCC2=NC(=NN2)C3=CC=NC=C3

InChI

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