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

Systemtic Name: 1-(phenylmethyl)-3-[1-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Openeye Name: 1-benzyl-3-[1-[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea CAS Name: 1-(phenylmethyl)-3-[1-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]ethyl]urea IUPAC Name: 1-benzyl-3-[1-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)ethyl]urea Traditional Name: 1-benzyl-3-[1-[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]urea Formula: C17H18N6O MolecularWeight: 322.36442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NN1)C2=CN=CC=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C1=NC(=NN1)C2=CN=CC=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H18N6O/c1-12(20-17(24)19-10-13-6-3-2-4-7-13)15-21-16(23-22-15)14-8-5-9-18-11-14/h2-9,11-12H,10H2,1H3,(H2,19,20,24)(H,21,22,23)