diethyl-methyl-[2-[3-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethyl]azanium

Systemtic Name: diethyl-methyl-[2-[3-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethyl]azanium Openeye Name: diethyl-methyl-[2-[4-oxo-3-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylethyl]ammonium CAS Name: diethyl-methyl-[2-[[3-(4-methylphenyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]ethyl]ammonium IUPAC Name: diethyl-methyl-[2-[3-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylethyl]azanium Traditional Name: diethyl-[2-[[4-keto-3-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]ethyl]-methyl-ammonium Formula: C20H26N3OS2+ MolecularWeight: 388.56994

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCSC1=NC2=C(C=CS2)C(=O)N1C3=CC=C(C=C3)C

Isomeric SMILES

CC[N+](C)(CC)CCSC1=NC2=C(C=CS2)C(=O)N1C3=CC=C(C=C3)C

InChI

InChI=1S/C20H26N3OS2/c1-5-23(4,6-2)12-14-26-20-21-18-17(11-13-25-18)19(24)22(20)16-9-7-15(3)8-10-16/h7-11,13H,5-6,12,14H2,1-4H3/q+1