N-[5-[(6-chloranylpyridin-3-yl)methyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide

Systemtic Name: N-[5-[(6-chloranylpyridin-3-yl)methyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide Openeye Name: N-[5-[(6-chloro-3-pyridyl)methyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide CAS Name: N-[5-[(6-chloro-3-pyridinyl)methyl]-1,3,4-thiadiazol-2-yl]-4-methylbenzamide IUPAC Name: N-[5-[(6-chloropyridin-3-yl)methyl]-1,3,4-thiadiazol-2-yl]-4-methylbenzamide Traditional Name: N-[5-[(6-chloro-3-pyridyl)methyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CN=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS/c1-10-2-5-12(6-3-10)15(22)19-16-21-20-14(23-16)8-11-4-7-13(17)18-9-11/h2-7,9H,8H2,1H3,(H,19,21,22)