5-(2-bromanyl-4-methyl-phenyl)-3,7-dimethyl-1-propyl-pyrazolo[4,3-c][1,2,5]benzotriazepine

Systemtic Name: 5-(2-bromanyl-4-methyl-phenyl)-3,7-dimethyl-1-propyl-pyrazolo[4,3-c][1,2,5]benzotriazepine Openeye Name: 5-(2-bromo-4-methyl-phenyl)-3,7-dimethyl-1-propyl-pyrazolo[4,3-c][1,2,5]benzotriazepine CAS Name: 5-(2-bromo-4-methylphenyl)-3,7-dimethyl-1-propylpyrazolo[4,3-c][1,2,5]benzotriazepine IUPAC Name: 5-(2-bromo-4-methylphenyl)-3,7-dimethyl-1-propylpyrazolo[4,3-c][1,2,5]benzotriazepine Traditional Name: 5-(2-bromo-4-methyl-phenyl)-3,7-dimethyl-1-propyl-pyrazolo[4,3-c][1,2,5]benzotriazepine Formula: C21H22BrN5 MolecularWeight: 424.33688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC3=C(C=C(C=C3)C)N(N=C2C(=N1)C)C4=C(C=C(C=C4)C)Br

Isomeric SMILES

CCCN1C2=NC3=C(C=C(C=C3)C)N(N=C2C(=N1)C)C4=C(C=C(C=C4)C)Br

InChI

InChI=1S/C21H22BrN5/c1-5-10-26-21-20(15(4)24-26)25-27(18-9-7-13(2)11-16(18)22)19-12-14(3)6-8-17(19)23-21/h6-9,11-12H,5,10H2,1-4H3