4-[[5-azanyl-1-(5-pyridin-2-ylthiophen-2-yl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-1-(5-pyridin-2-ylthiophen-2-yl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-amino-1-[5-(2-pyridyl)thiophene-2-carbonyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[5-amino-1-[oxo-[5-(2-pyridinyl)-2-thiophenyl]methyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(5-pyridin-2-ylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-amino-1-[5-(2-pyridyl)thiophene-2-carbonyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C18H15N7O3S2 MolecularWeight: 441.4868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(S2)C(=O)N3C(=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(S2)C(=O)N3C(=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C18H15N7O3S2/c19-17-23-18(22-11-4-6-12(7-5-11)30(20,27)28)24-25(17)16(26)15-9-8-14(29-15)13-3-1-2-10-21-13/h1-10H,(H2,20,27,28)(H3,19,22,23,24)