1-[3-(aminomethyl)phenyl]-3-(1-methylpyrazol-4-yl)urea

Systemtic Name: 1-[3-(aminomethyl)phenyl]-3-(1-methylpyrazol-4-yl)urea Openeye Name: 1-[3-(aminomethyl)phenyl]-3-(1-methylpyrazol-4-yl)urea CAS Name: 1-[3-(aminomethyl)phenyl]-3-(1-methyl-4-pyrazolyl)urea IUPAC Name: 1-[3-(aminomethyl)phenyl]-3-(1-methylpyrazol-4-yl)urea Traditional Name: 1-[3-(aminomethyl)phenyl]-3-(1-methylpyrazol-4-yl)urea Formula: C12H15N5O MolecularWeight: 245.2804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC(=O)NC2=CC=CC(=C2)CN

Isomeric SMILES

CN1C=C(C=N1)NC(=O)NC2=CC=CC(=C2)CN

InChI

InChI=1S/C12H15N5O/c1-17-8-11(7-14-17)16-12(18)15-10-4-2-3-9(5-10)6-13/h2-5,7-8H,6,13H2,1H3,(H2,15,16,18)