4-methyl-N-[4-[4-methyl-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-[4-methyl-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-[4-methyl-5-(2-morpholinoethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-[4-methyl-5-[2-(4-morpholinyl)ethylthio]-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-[4-methyl-5-(2-morpholin-4-ylethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-[4-methyl-5-(2-morpholinoethylthio)-1,2,4-triazol-3-yl]phenyl]benzenesulfonamide Formula: C22H27N5O3S2 MolecularWeight: 473.61148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCCN4CCOCC4

InChI

InChI=1S/C22H27N5O3S2/c1-17-3-9-20(10-4-17)32(28,29)25-19-7-5-18(6-8-19)21-23-24-22(26(21)2)31-16-13-27-11-14-30-15-12-27/h3-10,25H,11-16H2,1-2H3