2-(4-azanyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl-dimethyl-azanium

Systemtic Name: 2-(4-azanyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl-dimethyl-azanium Openeye Name: 2-(4-amino-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl-dimethyl-ammonium CAS Name: 2-[(4-amino-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]ethyl-dimethylammonium IUPAC Name: 2-(4-amino-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylethyl-dimethylazanium Traditional Name: 2-[(4-amino-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]ethyl-dimethyl-ammonium Formula: C16H19N4S2+ MolecularWeight: 331.47886

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N

Isomeric SMILES

C[NH+](C)CCSC1=NC(=C2C(=CSC2=N1)C3=CC=CC=C3)N

InChI

InChI=1S/C16H18N4S2/c1-20(2)8-9-21-16-18-14(17)13-12(10-22-15(13)19-16)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H2,17,18,19)/p+1