1-[4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]but-3-yn-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]but-3-yn-2-yl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[3-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]-1-methyl-prop-2-ynyl]urea CAS Name: 1-hydroxy-1-[4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)-3-pyrazolyl]but-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-[4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]but-3-yn-2-yl]urea Traditional Name: 1-hydroxy-1-[3-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]-1-methyl-prop-2-ynyl]urea Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C#CC(C)N(C(=O)N)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C#CC(C)N(C(=O)N)O

InChI

InChI=1S/C22H22N4O3/c1-15-4-7-17(8-5-15)21-14-18(9-6-16(2)26(28)22(23)27)24-25(21)19-10-12-20(29-3)13-11-19/h4-5,7-8,10-14,16,28H,1-3H3,(H2,23,27)