1-(5-azanyl-1,3-ditert-butyl-pyrazol-4-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea

Systemtic Name: 1-(5-azanyl-1,3-ditert-butyl-pyrazol-4-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea Openeye Name: 1-(5-amino-1,3-ditert-butyl-pyrazol-4-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea CAS Name: 1-(5-amino-1,3-ditert-butyl-4-pyrazolyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea IUPAC Name: 1-(5-amino-1,3-ditert-butylpyrazol-4-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea Traditional Name: 1-(5-amino-1,3-ditert-butyl-pyrazol-4-yl)-3-homoveratryl-urea Formula: C22H35N5O3 MolecularWeight: 417.545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1NC(=O)NCCC2=CC(=C(C=C2)OC)OC)N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1NC(=O)NCCC2=CC(=C(C=C2)OC)OC)N)C(C)(C)C

InChI

InChI=1S/C22H35N5O3/c1-21(2,3)18-17(19(23)27(26-18)22(4,5)6)25-20(28)24-12-11-14-9-10-15(29-7)16(13-14)30-8/h9-10,13H,11-12,23H2,1-8H3,(H2,24,25,28)