N-[(3,4-dimethoxyphenyl)methyl]thian-4-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]thian-4-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]tetrahydrothiopyran-4-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-thianamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]thian-4-amine Traditional Name: tetrahydrothiopyran-4-yl(veratryl)amine Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CCSCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CCSCC2)OC

InChI

InChI=1S/C14H21NO2S/c1-16-13-4-3-11(9-14(13)17-2)10-15-12-5-7-18-8-6-12/h3-4,9,12,15H,5-8,10H2,1-2H3