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

Systemtic Name: 3-phenyl-5-[5-[(3S)-3-(phenylmethyl)piperazin-1-yl]-1,2,4-triazin-3-yl]-1H-indazole Openeye Name: 5-[5-[(3S)-3-benzylpiperazin-1-yl]-1,2,4-triazin-3-yl]-3-phenyl-1H-indazole CAS Name: 3-phenyl-5-[5-[(3S)-3-(phenylmethyl)-1-piperazinyl]-1,2,4-triazin-3-yl]-1H-indazole IUPAC Name: 5-[5-[(3S)-3-benzylpiperazin-1-yl]-1,2,4-triazin-3-yl]-3-phenyl-1H-indazole Traditional Name: 5-[5-[(3S)-3-benzylpiperazino]-1,2,4-triazin-3-yl]-3-phenyl-1H-indazole Formula: C27H25N7 MolecularWeight: 447.5343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)CC2=CC=CC=C2)C3=CN=NC(=N3)C4=CC5=C(C=C4)NN=C5C6=CC=CC=C6

Isomeric SMILES

C1CN(C[C@@H](N1)CC2=CC=CC=C2)C3=CN=NC(=N3)C4=CC5=C(C=C4)NN=C5C6=CC=CC=C6

InChI

InChI=1S/C27H25N7/c1-3-7-19(8-4-1)15-22-18-34(14-13-28-22)25-17-29-33-27(30-25)21-11-12-24-23(16-21)26(32-31-24)20-9-5-2-6-10-20/h1-12,16-17,22,28H,13-15,18H2,(H,31,32)/t22-/m0/s1