1-[1-butyl-2-oxidanylidene-4-(5-oxidanyl-2-propan-2-yloxy-phenyl)pyridin-3-yl]-3-[2-tert-butyl-5-(pyrazol-1-ylmethyl)phenyl]urea

Systemtic Name: 1-[1-butyl-2-oxidanylidene-4-(5-oxidanyl-2-propan-2-yloxy-phenyl)pyridin-3-yl]-3-[2-tert-butyl-5-(pyrazol-1-ylmethyl)phenyl]urea Openeye Name: 1-[1-butyl-4-(5-hydroxy-2-isopropoxy-phenyl)-2-oxo-3-pyridyl]-3-[2-tert-butyl-5-(pyrazol-1-ylmethyl)phenyl]urea CAS Name: 1-[1-butyl-4-(5-hydroxy-2-propan-2-yloxyphenyl)-2-oxo-3-pyridinyl]-3-[2-tert-butyl-5-(1-pyrazolylmethyl)phenyl]urea IUPAC Name: 1-[1-butyl-4-(5-hydroxy-2-propan-2-yloxyphenyl)-2-oxopyridin-3-yl]-3-[2-tert-butyl-5-(pyrazol-1-ylmethyl)phenyl]urea Traditional Name: 1-[1-butyl-4-(5-hydroxy-2-isopropoxy-phenyl)-2-keto-3-pyridyl]-3-[2-tert-butyl-5-(pyrazol-1-ylmethyl)phenyl]urea Formula: C33H41N5O4 MolecularWeight: 571.70974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=C(C1=O)NC(=O)NC2=C(C=CC(=C2)CN3C=CC=N3)C(C)(C)C)C4=C(C=CC(=C4)O)OC(C)C

Isomeric SMILES

CCCCN1C=CC(=C(C1=O)NC(=O)NC2=C(C=CC(=C2)CN3C=CC=N3)C(C)(C)C)C4=C(C=CC(=C4)O)OC(C)C

InChI

InChI=1S/C33H41N5O4/c1-7-8-16-37-18-14-25(26-20-24(39)11-13-29(26)42-22(2)3)30(31(37)40)36-32(41)35-28-19-23(21-38-17-9-15-34-38)10-12-27(28)33(4,5)6/h9-15,17-20,22,39H,7-8,16,21H2,1-6H3,(H2,35,36,41)