(2E)-2-(7-chloranyl-1,2-dihydroindazol-3-ylidene)-5-(4-cyclohexylpiperazin-1-yl)benzimidazole

Systemtic Name: (2E)-2-(7-chloranyl-1,2-dihydroindazol-3-ylidene)-5-(4-cyclohexylpiperazin-1-yl)benzimidazole Openeye Name: (2E)-2-(7-chloro-1,2-dihydroindazol-3-ylidene)-5-(4-cyclohexylpiperazin-1-yl)benzimidazole CAS Name: (2E)-2-(7-chloro-1,2-dihydroindazol-3-ylidene)-5-(4-cyclohexyl-1-piperazinyl)benzimidazole IUPAC Name: (2E)-2-(7-chloro-1,2-dihydroindazol-3-ylidene)-5-(4-cyclohexylpiperazin-1-yl)benzimidazole Traditional Name: (2E)-2-(7-chloroindazolin-3-ylidene)-5-(4-cyclohexylpiperazino)benzimidazole Formula: C24H27ClN6 MolecularWeight: 434.96438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C3=CC4=NC(=C5C6=C(C(=CC=C6)Cl)NN5)N=C4C=C3

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C3=CC4=N/C(=C/5\C6=C(C(=CC=C6)Cl)NN5)/N=C4C=C3

InChI

InChI=1S/C24H27ClN6/c25-19-8-4-7-18-22(19)28-29-23(18)24-26-20-10-9-17(15-21(20)27-24)31-13-11-30(12-14-31)16-5-2-1-3-6-16/h4,7-10,15-16,28-29H,1-3,5-6,11-14H2/b24-23+