3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]propyl-dimethyl-azanium Openeye Name: dimethyl-[3-[[(4S)-thiochroman-4-yl]ammonio]propyl]ammonium CAS Name: 3-[[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]propyl-dimethylazanium Traditional Name: dimethyl-[3-[[(4S)-thiochroman-4-yl]ammonio]propyl]ammonium Formula: C14H24N2S+2 MolecularWeight: 252.41876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2S/c1-16(2)10-5-9-15-13-8-11-17-14-7-4-3-6-12(13)14/h3-4,6-7,13,15H,5,8-11H2,1-2H3/p+2/t13-/m0/s1