2-[1-(4-chlorophenyl)propylsulfonyl]-5-methylsulfonyl-1,3,4-thiadiazole

Systemtic Name: 2-[1-(4-chlorophenyl)propylsulfonyl]-5-methylsulfonyl-1,3,4-thiadiazole Openeye Name: 2-[1-(4-chlorophenyl)propylsulfonyl]-5-methylsulfonyl-1,3,4-thiadiazole CAS Name: 2-[1-(4-chlorophenyl)propylsulfonyl]-5-methylsulfonyl-1,3,4-thiadiazole IUPAC Name: 2-[1-(4-chlorophenyl)propylsulfonyl]-5-methylsulfonyl-1,3,4-thiadiazole Traditional Name: 2-[1-(4-chlorophenyl)propylsulfonyl]-5-mesyl-1,3,4-thiadiazole Formula: C12H13ClN2O4S3 MolecularWeight: 380.89062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=NN=C(S2)S(=O)(=O)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=NN=C(S2)S(=O)(=O)C

InChI

InChI=1S/C12H13ClN2O4S3/c1-3-10(8-4-6-9(13)7-5-8)22(18,19)12-15-14-11(20-12)21(2,16)17/h4-7,10H,3H2,1-2H3