3-[2,6-di(propan-2-yl)phenyl]-1,1-bis(pyridin-2-ylmethyl)urea

Systemtic Name: 3-[2,6-di(propan-2-yl)phenyl]-1,1-bis(pyridin-2-ylmethyl)urea Openeye Name: 3-(2,6-diisopropylphenyl)-1,1-bis(2-pyridylmethyl)urea CAS Name: 3-[2,6-di(propan-2-yl)phenyl]-1,1-bis(2-pyridinylmethyl)urea IUPAC Name: 3-[2,6-di(propan-2-yl)phenyl]-1,1-bis(pyridin-2-ylmethyl)urea Traditional Name: 3-(2,6-diisopropylphenyl)-1,1-bis(2-pyridylmethyl)urea Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O/c1-18(2)22-12-9-13-23(19(3)4)24(22)28-25(30)29(16-20-10-5-7-14-26-20)17-21-11-6-8-15-27-21/h5-15,18-19H,16-17H2,1-4H3,(H,28,30)