1-(3-tert-butyl-5-methoxy-2-oxidanyl-phenyl)-3-(pyridin-3-ylmethyl)urea hydrochloride

Systemtic Name: 1-(3-tert-butyl-5-methoxy-2-oxidanyl-phenyl)-3-(pyridin-3-ylmethyl)urea hydrochloride Openeye Name: 1-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-3-(3-pyridylmethyl)urea hydrochloride CAS Name: 1-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-3-(3-pyridinylmethyl)urea hydrochloride IUPAC Name: 1-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-3-(pyridin-3-ylmethyl)urea hydrochloride Traditional Name: 1-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-3-(3-pyridylmethyl)urea hydrochloride Formula: C18H24ClN3O3 MolecularWeight: 365.85446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)NC(=O)NCC2=CN=CC=C2)OC.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)NC(=O)NCC2=CN=CC=C2)OC.Cl

InChI

InChI=1S/C18H23N3O3.ClH/c1-18(2,3)14-8-13(24-4)9-15(16(14)22)21-17(23)20-11-12-6-5-7-19-10-12;/h5-10,22H,11H2,1-4H3,(H2,20,21,23);1H