2-[[5-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(2-methyl-5-morpholinosulfonyl-phenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(2-methyl-5-morpholinosulfonyl-phenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)N

InChI

InChI=1S/C21H23N5O4S2/c1-15-7-8-17(32(28,29)25-9-11-30-12-10-25)13-18(15)20-23-24-21(31-14-19(22)27)26(20)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H2,22,27)