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

Systemtic Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thiophene-2-carboxamide Openeye Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thiophene-2-carboxamide CAS Name: N-[8-(1-pyrrolidinylsulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]-2-thiophenecarboxamide IUPAC Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thiophene-2-carboxamide Traditional Name: N-(8-pyrrolidinosulfonyl-5H-[1,2,4]triazin[5,6-b]indol-3-yl)thiophene-2-carboxamide Formula: C18H16N6O3S2 MolecularWeight: 428.48804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC4=C3N=NC(=N4)NC(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC4=C3N=NC(=N4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C18H16N6O3S2/c25-17(14-4-3-9-28-14)21-18-20-16-15(22-23-18)12-10-11(5-6-13(12)19-16)29(26,27)24-7-1-2-8-24/h3-6,9-10H,1-2,7-8H2,(H2,19,20,21,23,25)