N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-butanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(3-cyano-6-isopropyl-2-pyridyl)sulfanyl]butanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(3-cyano-6-propan-2-yl-2-pyridinyl)thio]butanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-(3-cyano-6-propan-2-ylpyridin-2-yl)sulfanylbutanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(3-cyano-6-isopropyl-2-pyridyl)thio]butyramide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=C(C=CC(=N2)C(C)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=C(C=CC(=N2)C(C)C)C#N

InChI

InChI=1S/C21H24ClN3O3S/c1-6-19(29-21-13(11-23)7-8-15(25-21)12(2)3)20(26)24-16-9-14(22)17(27-4)10-18(16)28-5/h7-10,12,19H,6H2,1-5H3,(H,24,26)