5-(2-chlorophenyl)-8-methoxy-3-methyl-7-propan-2-yloxy-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine

Systemtic Name: 5-(2-chlorophenyl)-8-methoxy-3-methyl-7-propan-2-yloxy-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Openeye Name: 5-(2-chlorophenyl)-7-isopropoxy-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine CAS Name: 5-(2-chlorophenyl)-8-methoxy-3-methyl-7-propan-2-yloxy-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine IUPAC Name: 5-(2-chlorophenyl)-8-methoxy-3-methyl-7-propan-2-yloxy-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Traditional Name: 5-(2-chlorophenyl)-7-isopropoxy-8-methoxy-3-methyl-1,2-dihydropyrazolo[3,4-b][1,4]benzodiazepine Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)OC(C)C)OC)NN1

Isomeric SMILES

CC1=C2C(=NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)OC(C)C)OC)NN1

InChI

InChI=1S/C21H21ClN4O2/c1-11(2)28-18-9-14-16(10-17(18)27-4)23-21-19(12(3)25-26-21)24-20(14)13-7-5-6-8-15(13)22/h5-11H,1-4H3,(H2,23,25,26)