5-(3,4-dimethylphenyl)-9-piperidin-1-yl-benzimidazolo[2,1-a]phthalazine

Systemtic Name: 5-(3,4-dimethylphenyl)-9-piperidin-1-yl-benzimidazolo[2,1-a]phthalazine Openeye Name: 5-(3,4-dimethylphenyl)-9-(1-piperidyl)benzimidazolo[2,1-a]phthalazine CAS Name: 5-(3,4-dimethylphenyl)-9-(1-piperidinyl)benzimidazolo[2,1-a]phthalazine IUPAC Name: 5-(3,4-dimethylphenyl)-9-piperidin-1-ylbenzimidazolo[2,1-a]phthalazine Traditional Name: 5-(3,4-dimethylphenyl)-9-piperidino-benzimidazolo[2,1-a]phthalazine Formula: C27H26N4 MolecularWeight: 406.52214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN3C4=C(C=CC(=C4)N5CCCCC5)N=C3C6=CC=CC=C62)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN3C4=C(C=CC(=C4)N5CCCCC5)N=C3C6=CC=CC=C62)C

InChI

InChI=1S/C27H26N4/c1-18-10-11-20(16-19(18)2)26-22-8-4-5-9-23(22)27-28-24-13-12-21(17-25(24)31(27)29-26)30-14-6-3-7-15-30/h4-5,8-13,16-17H,3,6-7,14-15H2,1-2H3