N-[2-[4-(3-chloranyl-4-methoxy-phenyl)-5-[2-(4-morpholin-4-ylsulfonylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]ethanamide

Systemtic Name: N-[2-[4-(3-chloranyl-4-methoxy-phenyl)-5-[2-(4-morpholin-4-ylsulfonylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]ethanamide Openeye Name: N-[2-[4-(3-chloro-4-methoxy-phenyl)-5-[2-(4-morpholinosulfonylphenyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]acetamide CAS Name: N-[2-[4-(3-chloro-4-methoxyphenyl)-5-[[2-[4-(4-morpholinylsulfonyl)phenyl]-2-oxoethyl]thio]-1,2,4-triazol-3-yl]ethyl]acetamide IUPAC Name: N-[2-[4-(3-chloro-4-methoxyphenyl)-5-[2-(4-morpholin-4-ylsulfonylphenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]acetamide Traditional Name: N-[2-[4-(3-chloro-4-methoxy-phenyl)-5-[[2-keto-2-(4-morpholinosulfonylphenyl)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]acetamide Formula: C25H28ClN5O6S2 MolecularWeight: 594.10272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=NN=C(N1C2=CC(=C(C=C2)OC)Cl)SCC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(=O)NCCC1=NN=C(N1C2=CC(=C(C=C2)OC)Cl)SCC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H28ClN5O6S2/c1-17(32)27-10-9-24-28-29-25(31(24)19-5-8-23(36-2)21(26)15-19)38-16-22(33)18-3-6-20(7-4-18)39(34,35)30-11-13-37-14-12-30/h3-8,15H,9-14,16H2,1-2H3,(H,27,32)