(3S)-N-(3,4-dimethylphenyl)-1-(thian-4-yl)piperidin-3-amine

Systemtic Name: (3S)-N-(3,4-dimethylphenyl)-1-(thian-4-yl)piperidin-3-amine Openeye Name: (3S)-N-(3,4-dimethylphenyl)-1-tetrahydrothiopyran-4-yl-piperidin-3-amine CAS Name: (3S)-N-(3,4-dimethylphenyl)-1-(4-thianyl)-3-piperidinamine IUPAC Name: (3S)-N-(3,4-dimethylphenyl)-1-(thian-4-yl)piperidin-3-amine Traditional Name: (3,4-dimethylphenyl)-[(3S)-1-tetrahydrothiopyran-4-yl-3-piperidyl]amine Formula: C18H28N2S MolecularWeight: 304.49332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCN(C2)C3CCSCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C3CCSCC3)C

InChI

InChI=1S/C18H28N2S/c1-14-5-6-16(12-15(14)2)19-17-4-3-9-20(13-17)18-7-10-21-11-8-18/h5-6,12,17-19H,3-4,7-11,13H2,1-2H3/t17-/m0/s1