tert-butyl 3-(3-phenylazanyl-1H-pyrazol-5-yl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(3-phenylazanyl-1H-pyrazol-5-yl)indole-1-carboxylate Openeye Name: tert-butyl 3-(3-anilino-1H-pyrazol-5-yl)indole-1-carboxylate CAS Name: 3-(3-anilino-1H-pyrazol-5-yl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-anilino-1H-pyrazol-5-yl)indole-1-carboxylate Traditional Name: 3-(3-anilino-1H-pyrazol-5-yl)indole-1-carboxylic acid tert-butyl ester Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CC(=NN3)NC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CC(=NN3)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-22(2,3)28-21(27)26-14-17(16-11-7-8-12-19(16)26)18-13-20(25-24-18)23-15-9-5-4-6-10-15/h4-14H,1-3H3,(H2,23,24,25)