3-ethyl-5-[5-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole

Systemtic Name: 3-ethyl-5-[5-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Openeye Name: 3-ethyl-5-[5-[(3S)-3-isobutylpiperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole CAS Name: 3-ethyl-5-[5-[(3S)-3-(2-methylpropyl)-1-piperazinyl]-1,2,4-triazin-3-yl]-2H-indazole IUPAC Name: 3-ethyl-5-[5-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Traditional Name: 3-ethyl-5-[5-[(3S)-3-isobutylpiperazino]-1,2,4-triazin-3-yl]-2H-indazole Formula: C20H27N7 MolecularWeight: 365.47528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCNC(C4)CC(C)C

Isomeric SMILES

CCC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCN[C@H](C4)CC(C)C

InChI

InChI=1S/C20H27N7/c1-4-17-16-10-14(5-6-18(16)25-24-17)20-23-19(11-22-26-20)27-8-7-21-15(12-27)9-13(2)3/h5-6,10-11,13,15,21H,4,7-9,12H2,1-3H3,(H,24,25)/t15-/m0/s1