3-methoxy-N-(5-methyl-8-pyrrolidin-1-ylsulfonyl-[1,2,4]triazino[5,6-b]indol-3-yl)benzamide

Systemtic Name: 3-methoxy-N-(5-methyl-8-pyrrolidin-1-ylsulfonyl-[1,2,4]triazino[5,6-b]indol-3-yl)benzamide Openeye Name: 3-methoxy-N-(5-methyl-8-pyrrolidin-1-ylsulfonyl-[1,2,4]triazino[5,6-b]indol-3-yl)benzamide CAS Name: 3-methoxy-N-[5-methyl-8-(1-pyrrolidinylsulfonyl)-[1,2,4]triazino[5,6-b]indol-3-yl]benzamide IUPAC Name: 3-methoxy-N-(5-methyl-8-pyrrolidin-1-ylsulfonyl-[1,2,4]triazino[5,6-b]indol-3-yl)benzamide Traditional Name: 3-methoxy-N-(5-methyl-8-pyrrolidinosulfonyl-[1,2,4]triazin[5,6-b]indol-3-yl)benzamide Formula: C22H22N6O4S MolecularWeight: 466.51288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C4=C1N=C(N=N4)NC(=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C4=C1N=C(N=N4)NC(=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C22H22N6O4S/c1-27-18-9-8-16(33(30,31)28-10-3-4-11-28)13-17(18)19-20(27)23-22(26-25-19)24-21(29)14-6-5-7-15(12-14)32-2/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,23,24,26,29)