(2E)-2-(4-methoxy-1,2-dihydroindazol-3-ylidene)-5-(4-methylpiperazin-1-yl)benzimidazole

Systemtic Name: (2E)-2-(4-methoxy-1,2-dihydroindazol-3-ylidene)-5-(4-methylpiperazin-1-yl)benzimidazole Openeye Name: (2E)-2-(4-methoxy-1,2-dihydroindazol-3-ylidene)-5-(4-methylpiperazin-1-yl)benzimidazole CAS Name: (2E)-2-(4-methoxy-1,2-dihydroindazol-3-ylidene)-5-(4-methyl-1-piperazinyl)benzimidazole IUPAC Name: (2E)-2-(4-methoxy-1,2-dihydroindazol-3-ylidene)-5-(4-methylpiperazin-1-yl)benzimidazole Traditional Name: (2E)-2-(4-methoxyindazolin-3-ylidene)-5-(4-methylpiperazino)benzimidazole Formula: C20H22N6O MolecularWeight: 362.42828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=NC(=C4C5=C(C=CC=C5OC)NN4)N=C3C=C2

Isomeric SMILES

CN1CCN(CC1)C2=CC3=N/C(=C/4\C5=C(C=CC=C5OC)NN4)/N=C3C=C2

InChI

InChI=1S/C20H22N6O/c1-25-8-10-26(11-9-25)13-6-7-14-16(12-13)22-20(21-14)19-18-15(23-24-19)4-3-5-17(18)27-2/h3-7,12,23-24H,8-11H2,1-2H3/b20-19+