3-(5-chloranyl-2,4-dimethoxy-phenyl)-1,1-bis(pyridin-2-ylmethyl)urea

Systemtic Name: 3-(5-chloranyl-2,4-dimethoxy-phenyl)-1,1-bis(pyridin-2-ylmethyl)urea Openeye Name: 3-(5-chloro-2,4-dimethoxy-phenyl)-1,1-bis(2-pyridylmethyl)urea CAS Name: 3-(5-chloro-2,4-dimethoxyphenyl)-1,1-bis(2-pyridinylmethyl)urea IUPAC Name: 3-(5-chloro-2,4-dimethoxyphenyl)-1,1-bis(pyridin-2-ylmethyl)urea Traditional Name: 3-(5-chloro-2,4-dimethoxy-phenyl)-1,1-bis(2-pyridylmethyl)urea Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3)Cl)OC

InChI

InChI=1S/C21H21ClN4O3/c1-28-19-12-20(29-2)18(11-17(19)22)25-21(27)26(13-15-7-3-5-9-23-15)14-16-8-4-6-10-24-16/h3-12H,13-14H2,1-2H3,(H,25,27)