N-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide Openeye Name: N-[4-[2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl]sulfanylphenyl]-3,3-dimethyl-butanamide CAS Name: N-[4-[[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]thio]phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[4-[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl]sulfanylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[4-[[2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=C(C=C1)SCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C19H22ClN3O2S/c1-19(2,3)10-17(24)22-14-5-7-15(8-6-14)26-12-18(25)23-16-9-4-13(20)11-21-16/h4-9,11H,10,12H2,1-3H3,(H,22,24)(H,21,23,25)