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

Systemtic Name: [(4S)-3,4-dihydro-2H-thiochromen-4-yl]-[(4-dimethylaminophenyl)methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(4S)-thiochroman-4-yl]ammonium CAS Name: [(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-[(4-dimethylaminophenyl)methyl]ammonium IUPAC Name: [(4S)-3,4-dihydro-2H-thiochromen-4-yl]-[(4-dimethylaminophenyl)methyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(4S)-thiochroman-4-yl]ammonium Formula: C18H23N2S+ MolecularWeight: 299.45362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2S/c1-20(2)15-9-7-14(8-10-15)13-19-17-11-12-21-18-6-4-3-5-16(17)18/h3-10,17,19H,11-13H2,1-2H3/p+1/t17-/m0/s1