N-[(3,4,5-trimethoxyphenyl)methyl]thian-4-amine

Systemtic Name: N-[(3,4,5-trimethoxyphenyl)methyl]thian-4-amine Openeye Name: N-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrothiopyran-4-amine CAS Name: N-[(3,4,5-trimethoxyphenyl)methyl]-4-thianamine IUPAC Name: N-[(3,4,5-trimethoxyphenyl)methyl]thian-4-amine Traditional Name: tetrahydrothiopyran-4-yl-(3,4,5-trimethoxybenzyl)amine Formula: C15H23NO3S MolecularWeight: 297.41302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC2CCSCC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC2CCSCC2

InChI

InChI=1S/C15H23NO3S/c1-17-13-8-11(9-14(18-2)15(13)19-3)10-16-12-4-6-20-7-5-12/h8-9,12,16H,4-7,10H2,1-3H3