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

Systemtic Name: 5-(2-chlorophenyl)-7-methoxy-3-methyl-8-propan-2-yloxy-1-prop-2-enyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine Openeye Name: 1-allyl-5-(2-chlorophenyl)-8-isopropoxy-7-methoxy-3-methyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine CAS Name: 5-(2-chlorophenyl)-7-methoxy-3-methyl-8-propan-2-yloxy-1-prop-2-enyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine IUPAC Name: 5-(2-chlorophenyl)-7-methoxy-3-methyl-8-propan-2-yloxy-1-prop-2-enyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine Traditional Name: 1-allyl-5-(2-chlorophenyl)-8-isopropoxy-7-methoxy-3-methyl-2H-pyrazolo[3,4-b][1,4]benzodiazepine Formula: C24H25ClN4O2 MolecularWeight: 436.9339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)OC)OC(C)C)N(N1)CC=C

Isomeric SMILES

CC1=C2C(=NC3=CC(=C(C=C3C(=N2)C4=CC=CC=C4Cl)OC)OC(C)C)N(N1)CC=C

InChI

InChI=1S/C24H25ClN4O2/c1-6-11-29-24-22(15(4)28-29)27-23(16-9-7-8-10-18(16)25)17-12-20(30-5)21(31-14(2)3)13-19(17)26-24/h6-10,12-14,28H,1,11H2,2-5H3