3-(3-methyl-2H-indazol-5-yl)-N-(phenylmethyl)-5-[(3S)-3-(phenylmethyl)piperazin-1-yl]-1,2,4-triazin-6-amine

Systemtic Name: 3-(3-methyl-2H-indazol-5-yl)-N-(phenylmethyl)-5-[(3S)-3-(phenylmethyl)piperazin-1-yl]-1,2,4-triazin-6-amine Openeye Name: N-benzyl-5-[(3S)-3-benzylpiperazin-1-yl]-3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-6-amine CAS Name: 3-(3-methyl-2H-indazol-5-yl)-N-(phenylmethyl)-5-[(3S)-3-(phenylmethyl)-1-piperazinyl]-1,2,4-triazin-6-amine IUPAC Name: N-benzyl-5-[(3S)-3-benzylpiperazin-1-yl]-3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-6-amine Traditional Name: benzyl-[5-[(3S)-3-benzylpiperazino]-3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-6-yl]amine Formula: C29H30N8 MolecularWeight: 490.6021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NN1)C3=NC(=C(N=N3)NCC4=CC=CC=C4)N5CCNC(C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C2C=C(C=CC2=NN1)C3=NC(=C(N=N3)NCC4=CC=CC=C4)N5CCN[C@H](C5)CC6=CC=CC=C6

InChI

InChI=1S/C29H30N8/c1-20-25-17-23(12-13-26(25)34-33-20)27-32-29(28(36-35-27)31-18-22-10-6-3-7-11-22)37-15-14-30-24(19-37)16-21-8-4-2-5-9-21/h2-13,17,24,30H,14-16,18-19H2,1H3,(H,31,36)(H,33,34)/t24-/m0/s1