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

Systemtic Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]acetamide CAS Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[[5-[3-(4-morpholinylsulfonyl)phenyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-benzyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(diethylsulfamoyl)-4-methylphenyl]acetamide Traditional Name: 2-[[4-benzyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]acetamide Formula: C32H38N6O6S3 MolecularWeight: 698.87572

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5)C

InChI

InChI=1S/C32H38N6O6S3/c1-4-36(5-2)47(42,43)29-21-27(15-14-24(29)3)33-30(39)23-45-32-35-34-31(38(32)22-25-10-7-6-8-11-25)26-12-9-13-28(20-26)46(40,41)37-16-18-44-19-17-37/h6-15,20-21H,4-5,16-19,22-23H2,1-3H3,(H,33,39)