3-(1-benzothiophen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

Systemtic Name: 3-(1-benzothiophen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole Openeye Name: 3-(benzothiophen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole CAS Name: 3-(1-benzothiophen-2-yl)-5-[5-(1-pyrrolidinylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole IUPAC Name: 3-(1-benzothiophen-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole Traditional Name: 3-(benzothiophen-2-yl)-5-[5-(pyrrolidinomethyl)-1H-1,2,4-triazol-3-yl]-1H-indazole Formula: C22H20N6S MolecularWeight: 400.4994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=NC(=NN2)C3=CC4=C(C=C3)NN=C4C5=CC6=CC=CC=C6S5

Isomeric SMILES

C1CCN(C1)CC2=NC(=NN2)C3=CC4=C(C=C3)NN=C4C5=CC6=CC=CC=C6S5

InChI

InChI=1S/C22H20N6S/c1-2-6-18-14(5-1)12-19(29-18)21-16-11-15(7-8-17(16)24-26-21)22-23-20(25-27-22)13-28-9-3-4-10-28/h1-2,5-8,11-12H,3-4,9-10,13H2,(H,24,26)(H,23,25,27)