(2Z)-2-(5-bromanyl-1,2-dihydroindazol-3-ylidene)-5-(4-propan-2-ylpiperazin-1-yl)benzimidazole

Systemtic Name: (2Z)-2-(5-bromanyl-1,2-dihydroindazol-3-ylidene)-5-(4-propan-2-ylpiperazin-1-yl)benzimidazole Openeye Name: (2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)-5-(4-isopropylpiperazin-1-yl)benzimidazole CAS Name: (2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)-5-(4-propan-2-yl-1-piperazinyl)benzimidazole IUPAC Name: (2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)-5-(4-propan-2-ylpiperazin-1-yl)benzimidazole Traditional Name: (2Z)-2-(5-bromoindazolin-3-ylidene)-5-(4-isopropylpiperazino)benzimidazole Formula: C21H23BrN6 MolecularWeight: 439.35152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=CC3=NC(=C4C5=C(C=CC(=C5)Br)NN4)N=C3C=C2

Isomeric SMILES

CC(C)N1CCN(CC1)C2=CC3=N/C(=C\4/C5=C(C=CC(=C5)Br)NN4)/N=C3C=C2

InChI

InChI=1S/C21H23BrN6/c1-13(2)27-7-9-28(10-8-27)15-4-6-18-19(12-15)24-21(23-18)20-16-11-14(22)3-5-17(16)25-26-20/h3-6,11-13,25-26H,7-10H2,1-2H3/b21-20-