methyl 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylate

Systemtic Name: methyl 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylate Openeye Name: methyl 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylate CAS Name: 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylate Traditional Name: 3-methyl-1,7-diphenyl-6H-pyrazolo[3,4-b][1,4]diazepine-5-carboxylic acid methyl ester Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(CC(=N2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1N=C(CC(=N2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2/c1-14-19-20(25(24-14)16-11-7-4-8-12-16)23-17(15-9-5-3-6-10-15)13-18(22-19)21(26)27-2/h3-12H,13H2,1-2H3