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

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H24ClN5O4S2 MolecularWeight: 522.04006

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24ClN5O4S2/c1-2-28-21(16-6-4-3-5-7-16)25-26-22(28)33-15-20(29)24-17-8-9-18(23)19(14-17)34(30,31)27-10-12-32-13-11-27/h3-9,14H,2,10-13,15H2,1H3,(H,24,29)