2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(3-mesylphenyl)acetamide Formula: C15H20N4O3S3 MolecularWeight: 400.5393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCCNC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H20N4O3S3/c1-3-4-8-16-14-18-19-15(24-14)23-10-13(20)17-11-6-5-7-12(9-11)25(2,21)22/h5-7,9H,3-4,8,10H2,1-2H3,(H,16,18)(H,17,20)