2-phenyl-N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)ethanamide

Systemtic Name: 2-phenyl-N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)ethanamide Openeye Name: 2-phenyl-N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)acetamide CAS Name: 2-phenyl-N-[8-(1-pyrrolidinylsulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]acetamide IUPAC Name: 2-phenyl-N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)acetamide Traditional Name: 2-phenyl-N-(8-pyrrolidinosulfonyl-5H-[1,2,4]triazin[5,6-b]indol-3-yl)acetamide Formula: C21H20N6O3S MolecularWeight: 436.4869

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC4=C3N=NC(=N4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC4=C3N=NC(=N4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C21H20N6O3S/c28-18(12-14-6-2-1-3-7-14)23-21-24-20-19(25-26-21)16-13-15(8-9-17(16)22-20)31(29,30)27-10-4-5-11-27/h1-3,6-9,13H,4-5,10-12H2,(H2,22,23,24,26,28)