3-methoxy-N-[4-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide

Systemtic Name: 3-methoxy-N-[4-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide Openeye Name: 3-methoxy-N-[4-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]butyl]benzenesulfonamide CAS Name: 3-methoxy-N-[4-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]butyl]benzenesulfonamide IUPAC Name: 3-methoxy-N-[4-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide Traditional Name: 3-methoxy-N-[4-[(5-o-toluoylthiazol-2-yl)amino]butyl]benzenesulfonamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCCCCNS(=O)(=O)C3=CC=CC(=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCCCCNS(=O)(=O)C3=CC=CC(=C3)OC

InChI

InChI=1S/C22H25N3O4S2/c1-16-8-3-4-11-19(16)21(26)20-15-24-22(30-20)23-12-5-6-13-25-31(27,28)18-10-7-9-17(14-18)29-2/h3-4,7-11,14-15,25H,5-6,12-13H2,1-2H3,(H,23,24)