N-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-methyl-benzamide Openeye Name: N-[4-[2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl]sulfanylphenyl]-2-methyl-benzamide CAS Name: N-[4-[[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]thio]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl]sulfanylphenyl]-2-methylbenzamide Traditional Name: N-[4-[[2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl]thio]phenyl]-2-methyl-benzamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-14-4-2-3-5-18(14)21(27)24-16-7-9-17(10-8-16)28-13-20(26)25-19-11-6-15(22)12-23-19/h2-12H,13H2,1H3,(H,24,27)(H,23,25,26)