N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[(4-chlorophenyl)methylsulfonyl]ethanamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[(4-chlorophenyl)methylsulfonyl]ethanamide Openeye Name: 2-[(4-chlorophenyl)methylsulfonyl]-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-2-[(4-chlorophenyl)methylsulfonyl]acetamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[(4-chlorophenyl)methylsulfonyl]acetamide Traditional Name: 2-(4-chlorobenzyl)sulfonyl-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C15H18ClN3O3S3 MolecularWeight: 419.96972

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)CS(=O)(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3O3S3/c1-3-10(2)23-15-19-18-14(24-15)17-13(20)9-25(21,22)8-11-4-6-12(16)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,17,18,20)