5-pentyl-3-(phenylmethyl)-1,3,5-thiadiazinan-5-ium-2-thione

Systemtic Name: 5-pentyl-3-(phenylmethyl)-1,3,5-thiadiazinan-5-ium-2-thione Openeye Name: 3-benzyl-5-pentyl-1,3,5-thiadiazinan-5-ium-2-thione CAS Name: 5-pentyl-3-(phenylmethyl)-1,3,5-thiadiazinan-5-ium-2-thione IUPAC Name: 3-benzyl-5-pentyl-1,3,5-thiadiazinan-5-ium-2-thione Traditional Name: 5-amyl-3-benzyl-1,3,5-thiadiazinan-5-ium-2-thione Formula: C15H23N2S2+ MolecularWeight: 295.48652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+]1CN(C(=S)SC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCC[NH+]1CN(C(=S)SC1)CC2=CC=CC=C2

InChI

InChI=1S/C15H22N2S2/c1-2-3-7-10-16-12-17(15(18)19-13-16)11-14-8-5-4-6-9-14/h4-6,8-9H,2-3,7,10-13H2,1H3/p+1