5-[(3-chloranylpyridin-2-yl)sulfanylmethyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(3-chloranylpyridin-2-yl)sulfanylmethyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(3-chloro-2-pyridyl)sulfanylmethyl]-N-(p-tolylmethyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[(3-chloro-2-pyridinyl)thio]methyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(3-chloropyridin-2-yl)sulfanylmethyl]-N-[(4-methylphenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[(3-chloro-2-pyridyl)thio]methyl]-N-(4-methylbenzyl)-1,3,4-thiadiazole-2-carboxamide Formula: C17H15ClN4OS2 MolecularWeight: 390.9102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CSC3=C(C=CC=N3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NN=C(S2)CSC3=C(C=CC=N3)Cl

InChI

InChI=1S/C17H15ClN4OS2/c1-11-4-6-12(7-5-11)9-20-15(23)17-22-21-14(25-17)10-24-16-13(18)3-2-8-19-16/h2-8H,9-10H2,1H3,(H,20,23)