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

Systemtic Name: [(2S)-butan-2-yl]-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(4S)-thiochroman-4-yl]ammonium CAS Name: [(2S)-butan-2-yl]-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azanium Traditional Name: [(1S)-1-methylpropyl]-[(4S)-thiochroman-4-yl]ammonium Formula: C13H20NS+ MolecularWeight: 222.3696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]C1CCSC2=CC=CC=C12

Isomeric SMILES

CC[C@H](C)[NH2+][C@H]1CCSC2=CC=CC=C12

InChI

InChI=1S/C13H19NS/c1-3-10(2)14-12-8-9-15-13-7-5-4-6-11(12)13/h4-7,10,12,14H,3,8-9H2,1-2H3/p+1/t10-,12-/m0/s1