3-methyl-5-[6-phenethyl-5-[(3S)-3-propylpiperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole

Systemtic Name: 3-methyl-5-[6-phenethyl-5-[(3S)-3-propylpiperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Openeye Name: 3-methyl-5-[6-phenethyl-5-[(3S)-3-propylpiperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole CAS Name: 3-methyl-5-[6-phenethyl-5-[(3S)-3-propyl-1-piperazinyl]-1,2,4-triazin-3-yl]-2H-indazole IUPAC Name: 3-methyl-5-[6-phenethyl-5-[(3S)-3-propylpiperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Traditional Name: 3-methyl-5-[6-phenethyl-5-[(3S)-3-propylpiperazino]-1,2,4-triazin-3-yl]-2H-indazole Formula: C26H31N7 MolecularWeight: 441.57124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CN(CCN1)C2=C(N=NC(=N2)C3=CC4=C(NN=C4C=C3)C)CCC5=CC=CC=C5

Isomeric SMILES

CCC[C@H]1CN(CCN1)C2=C(N=NC(=N2)C3=CC4=C(NN=C4C=C3)C)CCC5=CC=CC=C5

InChI

InChI=1S/C26H31N7/c1-3-7-21-17-33(15-14-27-21)26-24(12-10-19-8-5-4-6-9-19)31-32-25(28-26)20-11-13-23-22(16-20)18(2)29-30-23/h4-6,8-9,11,13,16,21,27H,3,7,10,12,14-15,17H2,1-2H3,(H,29,30)/t21-/m0/s1