5,6-dimethyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-1-ium-4-amine

Systemtic Name: 5,6-dimethyl-2-(phenylmethylsulfanyl)thieno[2,3-d]pyrimidin-1-ium-4-amine Openeye Name: 2-benzylsulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-1-ium-4-amine CAS Name: 5,6-dimethyl-2-(phenylmethylthio)-4-thieno[2,3-d]pyrimidin-1-iumamine IUPAC Name: 2-benzylsulfanyl-5,6-dimethylthieno[2,3-d]pyrimidin-1-ium-4-amine Traditional Name: [2-(benzylthio)-5,6-dimethyl-thieno[2,3-d]pyrimidin-1-ium-4-yl]amine Formula: C15H16N3S2+ MolecularWeight: 302.43764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=[NH+]C(=NC(=C12)N)SCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=[NH+]C(=NC(=C12)N)SCC3=CC=CC=C3)C

InChI

InChI=1S/C15H15N3S2/c1-9-10(2)20-14-12(9)13(16)17-15(18-14)19-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H2,16,17,18)/p+1