[(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethyl-azanium Openeye Name: [(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethyl-ammonium CAS Name: [(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethylammonium IUPAC Name: [(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethylazanium Traditional Name: [(4S)-4-(5,6-dihydro-4H-1,3-thiazin-3-ium-2-ylamino)pentyl]-diethyl-ammonium Formula: C13H29N3S+2 MolecularWeight: 259.45446

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC1=[NH+]CCCS1

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC1=[NH+]CCCS1

InChI

InChI=1S/C13H27N3S/c1-4-16(5-2)10-6-8-12(3)15-13-14-9-7-11-17-13/h12H,4-11H2,1-3H3,(H,14,15)/p+2/t12-/m0/s1