N-[5-[(4-chloranylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-[5-[(4-chloranylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanyl-benzamide Openeye Name: N-[5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-isopropylsulfanyl-benzamide CAS Name: N-[5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-(propan-2-ylthio)benzamide IUPAC Name: N-[5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanylbenzamide Traditional Name: N-[5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl]-2-(isopropylthio)benzamide Formula: C19H18ClN3O2S2 MolecularWeight: 419.94812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC=C1C(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)SC1=CC=CC=C1C(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O2S2/c1-12(2)26-16-6-4-3-5-15(16)18(24)21-19-23-22-17(27-19)11-25-14-9-7-13(20)8-10-14/h3-10,12H,11H2,1-2H3,(H,21,23,24)