1-(3,4-dimethylphenyl)-N-(isoquinolin-5-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine

Systemtic Name: 1-(3,4-dimethylphenyl)-N-(isoquinolin-5-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine Openeye Name: 1-(3,4-dimethylphenyl)-N-(5-isoquinolylmethyl)-4,5,6,7-tetrahydroindazol-4-amine CAS Name: 1-(3,4-dimethylphenyl)-N-(5-isoquinolinylmethyl)-4,5,6,7-tetrahydroindazol-4-amine IUPAC Name: 1-(3,4-dimethylphenyl)-N-(isoquinolin-5-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine Traditional Name: [1-(3,4-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-(5-isoquinolylmethyl)amine Formula: C25H26N4 MolecularWeight: 382.50074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(CCC3)NCC4=CC=CC5=C4C=CN=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(CCC3)NCC4=CC=CC5=C4C=CN=C5)C

InChI

InChI=1S/C25H26N4/c1-17-9-10-21(13-18(17)2)29-25-8-4-7-24(23(25)16-28-29)27-15-20-6-3-5-19-14-26-12-11-22(19)20/h3,5-6,9-14,16,24,27H,4,7-8,15H2,1-2H3