3-chloranyl-N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-chloranyl-N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-chloro-N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-chloro-N-[5-[(3,5-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-chloro-N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-chloro-N-[5-[(3,5-dimethylbenzyl)thio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C18H16ClN3OS2 MolecularWeight: 389.92214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C18H16ClN3OS2/c1-11-6-12(2)8-13(7-11)10-24-18-22-21-17(25-18)20-16(23)14-4-3-5-15(19)9-14/h3-9H,10H2,1-2H3,(H,20,21,23)