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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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