3-tert-butyl-1-methyl-1-[2-[5-(1-methylpyrrol-2-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]urea

Systemtic Name: 3-tert-butyl-1-methyl-1-[2-[5-(1-methylpyrrol-2-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]urea Openeye Name: 3-tert-butyl-1-methyl-1-[2-[5-(1-methylpyrrol-2-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]urea CAS Name: 3-tert-butyl-1-methyl-1-[2-[5-(1-methyl-2-pyrrolyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]urea IUPAC Name: 3-tert-butyl-1-methyl-1-[2-[5-(1-methylpyrrol-2-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]urea Traditional Name: 3-tert-butyl-1-[2-keto-2-[3-(1-methylpyrrol-2-yl)-5-phenyl-2-pyrazolin-1-yl]ethyl]-1-methyl-urea Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(C)CC(=O)N1C(CC(=N1)C2=CC=CN2C)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)N(C)CC(=O)N1C(CC(=N1)C2=CC=CN2C)C3=CC=CC=C3

InChI

InChI=1S/C22H29N5O2/c1-22(2,3)23-21(29)26(5)15-20(28)27-19(16-10-7-6-8-11-16)14-17(24-27)18-12-9-13-25(18)4/h6-13,19H,14-15H2,1-5H3,(H,23,29)