N-(5-chloranyl-2,4-dimethoxy-phenyl)thian-4-amine

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)thian-4-amine Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)tetrahydrothiopyran-4-amine CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-4-thianamine IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)thian-4-amine Traditional Name: (5-chloro-2,4-dimethoxy-phenyl)-tetrahydrothiopyran-4-yl-amine Formula: C13H18ClNO2S MolecularWeight: 287.80552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2CCSCC2)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2CCSCC2)Cl)OC

InChI

InChI=1S/C13H18ClNO2S/c1-16-12-8-13(17-2)11(7-10(12)14)15-9-3-5-18-6-4-9/h7-9,15H,3-6H2,1-2H3