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

Systemtic Name: 3-methyl-5-[5-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Openeye Name: 5-[5-[(3S)-3-isobutylpiperazin-1-yl]-1,2,4-triazin-3-yl]-3-methyl-2H-indazole CAS Name: 3-methyl-5-[5-[(3S)-3-(2-methylpropyl)-1-piperazinyl]-1,2,4-triazin-3-yl]-2H-indazole IUPAC Name: 3-methyl-5-[5-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Traditional Name: 5-[5-[(3S)-3-isobutylpiperazino]-1,2,4-triazin-3-yl]-3-methyl-2H-indazole Formula: C19H25N7 MolecularWeight: 351.4487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCNC(C4)CC(C)C

Isomeric SMILES

CC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCN[C@H](C4)CC(C)C

InChI

InChI=1S/C19H25N7/c1-12(2)8-15-11-26(7-6-20-15)18-10-21-25-19(22-18)14-4-5-17-16(9-14)13(3)23-24-17/h4-5,9-10,12,15,20H,6-8,11H2,1-3H3,(H,23,24)/t15-/m0/s1