N-[[3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]methyl]thiophene-3-sulfonamide

Systemtic Name: N-[[3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]phenyl]methyl]thiophene-3-sulfonamide Openeye Name: N-[[3-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]phenyl]methyl]thiophene-3-sulfonamide CAS Name: N-[[3-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]phenyl]methyl]-3-thiophenesulfonamide IUPAC Name: N-[[3-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]phenyl]methyl]thiophene-3-sulfonamide Traditional Name: N-[3-[(5-o-toluoylthiazol-2-yl)amino]benzyl]thiophene-3-sulfonamide Formula: C22H19N3O3S3 MolecularWeight: 469.59956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC=CC(=C3)CNS(=O)(=O)C4=CSC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC=CC(=C3)CNS(=O)(=O)C4=CSC=C4

InChI

InChI=1S/C22H19N3O3S3/c1-15-5-2-3-8-19(15)21(26)20-13-23-22(30-20)25-17-7-4-6-16(11-17)12-24-31(27,28)18-9-10-29-14-18/h2-11,13-14,24H,12H2,1H3,(H,23,25)