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

Systemtic Name: 4-[[5-azanyl-1-(5-tert-butylthiophen-2-yl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-amino-1-(5-tert-butylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[5-amino-1-[(5-tert-butyl-2-thiophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(5-tert-butylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-amino-1-(5-tert-butylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C17H20N6O3S2 MolecularWeight: 420.5091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(S1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N

Isomeric SMILES

CC(C)(C)C1=CC=C(S1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N

InChI

InChI=1S/C17H20N6O3S2/c1-17(2,3)13-9-8-12(27-13)14(24)23-15(18)21-16(22-23)20-10-4-6-11(7-5-10)28(19,25)26/h4-9H,1-3H3,(H2,19,25,26)(H3,18,20,21,22)