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

Systemtic Name: N-[3,5-bis(chloranyl)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-(3,5-dichlorophenyl)acetamide CAS Name: N-(3,5-dichlorophenyl)-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-(3,5-dichlorophenyl)acetamide Traditional Name: 2-[[4-benzyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3,5-dichlorophenyl)acetamide Formula: C27H25Cl2N5O4S2 MolecularWeight: 618.5545

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3CC4=CC=CC=C4)SCC(=O)NC5=CC(=CC(=C5)Cl)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3CC4=CC=CC=C4)SCC(=O)NC5=CC(=CC(=C5)Cl)Cl

InChI

InChI=1S/C27H25Cl2N5O4S2/c28-21-14-22(29)16-23(15-21)30-25(35)18-39-27-32-31-26(34(27)17-19-5-2-1-3-6-19)20-7-4-8-24(13-20)40(36,37)33-9-11-38-12-10-33/h1-8,13-16H,9-12,17-18H2,(H,30,35)