[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-[(3-methylphenyl)methyl]azanium

Systemtic Name: [(4S)-3,4-dihydro-2H-thiochromen-4-yl]-[(3-methylphenyl)methyl]azanium Openeye Name: m-tolylmethyl-[(4S)-thiochroman-4-yl]ammonium CAS Name: [(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-[(3-methylphenyl)methyl]ammonium IUPAC Name: [(4S)-3,4-dihydro-2H-thiochromen-4-yl]-[(3-methylphenyl)methyl]azanium Traditional Name: (3-methylbenzyl)-[(4S)-thiochroman-4-yl]ammonium Formula: C17H20NS+ MolecularWeight: 270.4124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH2+]C2CCSC3=CC=CC=C23

Isomeric SMILES

CC1=CC(=CC=C1)C[NH2+][C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C17H19NS/c1-13-5-4-6-14(11-13)12-18-16-9-10-19-17-8-3-2-7-15(16)17/h2-8,11,16,18H,9-10,12H2,1H3/p+1/t16-/m0/s1