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

Systemtic Name: 3-(3-tert-butyl-5-methoxy-2-oxidanyl-phenyl)-1,1-bis(pyridin-2-ylmethyl)urea Openeye Name: 3-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-1,1-bis(2-pyridylmethyl)urea CAS Name: 3-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-1,1-bis(2-pyridinylmethyl)urea IUPAC Name: 3-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-1,1-bis(pyridin-2-ylmethyl)urea Traditional Name: 3-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-1,1-bis(2-pyridylmethyl)urea Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)NC(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)NC(=O)N(CC2=CC=CC=N2)CC3=CC=CC=N3)OC

InChI

InChI=1S/C24H28N4O3/c1-24(2,3)20-13-19(31-4)14-21(22(20)29)27-23(30)28(15-17-9-5-7-11-25-17)16-18-10-6-8-12-26-18/h5-14,29H,15-16H2,1-4H3,(H,27,30)