5-[3-[(4-chlorophenyl)methylsulfonyl]-2-phenyl-propyl]-3H-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[3-[(4-chlorophenyl)methylsulfonyl]-2-phenyl-propyl]-3H-1,3,4-thiadiazole-2-thione Openeye Name: 5-[3-[(4-chlorophenyl)methylsulfonyl]-2-phenyl-propyl]-3H-1,3,4-thiadiazole-2-thione CAS Name: 5-[3-[(4-chlorophenyl)methylsulfonyl]-2-phenylpropyl]-3H-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[3-[(4-chlorophenyl)methylsulfonyl]-2-phenylpropyl]-3H-1,3,4-thiadiazole-2-thione Traditional Name: 5-[3-(4-chlorobenzyl)sulfonyl-2-phenyl-propyl]-3H-1,3,4-thiadiazole-2-thione Formula: C18H17ClN2O2S3 MolecularWeight: 424.98778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2=NNC(=S)S2)CS(=O)(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CC2=NNC(=S)S2)CS(=O)(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O2S3/c19-16-8-6-13(7-9-16)11-26(22,23)12-15(14-4-2-1-3-5-14)10-17-20-21-18(24)25-17/h1-9,15H,10-12H2,(H,21,24)