1-[5-azanyl-3-tert-butyl-1-(2-methylphenyl)pyrazol-4-yl]-3-(pyridin-2-ylmethyl)urea

Systemtic Name: 1-[5-azanyl-3-tert-butyl-1-(2-methylphenyl)pyrazol-4-yl]-3-(pyridin-2-ylmethyl)urea Openeye Name: 1-[5-amino-3-tert-butyl-1-(o-tolyl)pyrazol-4-yl]-3-(2-pyridylmethyl)urea CAS Name: 1-[5-amino-3-tert-butyl-1-(2-methylphenyl)-4-pyrazolyl]-3-(2-pyridinylmethyl)urea IUPAC Name: 1-[5-amino-3-tert-butyl-1-(2-methylphenyl)pyrazol-4-yl]-3-(pyridin-2-ylmethyl)urea Traditional Name: 1-[5-amino-3-tert-butyl-1-(o-tolyl)pyrazol-4-yl]-3-(2-pyridylmethyl)urea Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C(C)(C)C)NC(=O)NCC3=CC=CC=N3)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C(C)(C)C)NC(=O)NCC3=CC=CC=N3)N

InChI

InChI=1S/C21H26N6O/c1-14-9-5-6-11-16(14)27-19(22)17(18(26-27)21(2,3)4)25-20(28)24-13-15-10-7-8-12-23-15/h5-12H,13,22H2,1-4H3,(H2,24,25,28)