1-[3-(aminomethyl)phenyl]-3-pyrimidin-2-yl-urea

Systemtic Name: 1-[3-(aminomethyl)phenyl]-3-pyrimidin-2-yl-urea Openeye Name: 1-[3-(aminomethyl)phenyl]-3-pyrimidin-2-yl-urea CAS Name: 1-[3-(aminomethyl)phenyl]-3-(2-pyrimidinyl)urea IUPAC Name: 1-[3-(aminomethyl)phenyl]-3-pyrimidin-2-ylurea Traditional Name: 1-[3-(aminomethyl)phenyl]-3-(2-pyrimidyl)urea Formula: C12H13N5O MolecularWeight: 243.26452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=NC=CC=N2)CN

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=NC=CC=N2)CN

InChI

InChI=1S/C12H13N5O/c13-8-9-3-1-4-10(7-9)16-12(18)17-11-14-5-2-6-15-11/h1-7H,8,13H2,(H2,14,15,16,17,18)