1-[1-butyl-2-oxidanylidene-4-[3-(pyridin-3-ylmethoxy)phenyl]pyridin-3-yl]-3-[2,6-di(propan-2-yl)phenyl]urea

Systemtic Name: 1-[1-butyl-2-oxidanylidene-4-[3-(pyridin-3-ylmethoxy)phenyl]pyridin-3-yl]-3-[2,6-di(propan-2-yl)phenyl]urea Openeye Name: 1-[1-butyl-2-oxo-4-[3-(3-pyridylmethoxy)phenyl]-3-pyridyl]-3-(2,6-diisopropylphenyl)urea CAS Name: 1-[1-butyl-2-oxo-4-[3-(3-pyridinylmethoxy)phenyl]-3-pyridinyl]-3-[2,6-di(propan-2-yl)phenyl]urea IUPAC Name: 1-[1-butyl-2-oxo-4-[3-(pyridin-3-ylmethoxy)phenyl]pyridin-3-yl]-3-[2,6-di(propan-2-yl)phenyl]urea Traditional Name: 1-[1-butyl-2-keto-4-[3-(3-pyridylmethoxy)phenyl]-3-pyridyl]-3-(2,6-diisopropylphenyl)urea Formula: C34H40N4O3 MolecularWeight: 552.7064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=C(C1=O)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C3=CC(=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

CCCCN1C=CC(=C(C1=O)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C3=CC(=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C34H40N4O3/c1-6-7-18-38-19-16-30(26-12-8-13-27(20-26)41-22-25-11-10-17-35-21-25)32(33(38)39)37-34(40)36-31-28(23(2)3)14-9-15-29(31)24(4)5/h8-17,19-21,23-24H,6-7,18,22H2,1-5H3,(H2,36,37,40)