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

Systemtic Name: 3-ethyl-5-[5-[(3S)-3-(phenylmethyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-2H-indazole Openeye Name: 5-[5-[(3S)-3-benzylpiperazin-1-yl]-1,2,4-triazin-3-yl]-3-ethyl-2H-indazole CAS Name: 3-ethyl-5-[5-[(3S)-3-(phenylmethyl)-1-piperazinyl]-1,2,4-triazin-3-yl]-2H-indazole IUPAC Name: 5-[5-[(3S)-3-benzylpiperazin-1-yl]-1,2,4-triazin-3-yl]-3-ethyl-2H-indazole Traditional Name: 5-[5-[(3S)-3-benzylpiperazino]-1,2,4-triazin-3-yl]-3-ethyl-2H-indazole Formula: C23H25N7 MolecularWeight: 399.4915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCNC(C4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=C2C=C(C=CC2=NN1)C3=NC(=CN=N3)N4CCN[C@H](C4)CC5=CC=CC=C5

InChI

InChI=1S/C23H25N7/c1-2-20-19-13-17(8-9-21(19)28-27-20)23-26-22(14-25-29-23)30-11-10-24-18(15-30)12-16-6-4-3-5-7-16/h3-9,13-14,18,24H,2,10-12,15H2,1H3,(H,27,28)/t18-/m0/s1