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

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2-[(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:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O4S2/c27-20(15-31-21-24-23-16-26(21)18-4-2-1-3-5-18)22-14-17-6-8-19(9-7-17)32(28,29)25-10-12-30-13-11-25/h1-9,16H,10-15H2,(H,22,27)