N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(2-chloranylpyridin-3-yl)oxymethyl]morpholine-4-carbothioamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(2-chloranylpyridin-3-yl)oxymethyl]morpholine-4-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(2-chloro-3-pyridyl)oxymethyl]morpholine-4-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-chloro-3-pyridinyl)oxymethyl]-4-morpholinecarbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2-chloropyridin-3-yl)oxymethyl]morpholine-4-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(2-chloro-3-pyridyl)oxymethyl]morpholine-4-carbothioamide Formula: C19H21Cl2N3O4S MolecularWeight: 458.35874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)N2CCOC(C2)COC3=C(N=CC=C3)Cl)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)N2CCOC(C2)COC3=C(N=CC=C3)Cl)OC)Cl

InChI

InChI=1S/C19H21Cl2N3O4S/c1-25-16-9-14(17(26-2)8-13(16)20)23-19(29)24-6-7-27-12(10-24)11-28-15-4-3-5-22-18(15)21/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,23,29)