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

Systemtic Name: 2-[[5-(4-morpholin-4-ylsulfonylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(4-morpholinosulfonylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-[4-(4-morpholinylsulfonyl)phenyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(4-morpholin-4-ylsulfonylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(4-morpholinosulfonylphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H21N5O4S2 MolecularWeight: 459.54184

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)N

InChI

InChI=1S/C20H21N5O4S2/c21-18(26)14-30-20-23-22-19(25(20)16-4-2-1-3-5-16)15-6-8-17(9-7-15)31(27,28)24-10-12-29-13-11-24/h1-9H,10-14H2,(H2,21,26)