N-(4-ethoxyphenyl)-2-[[6-[(4-fluorophenyl)methyl]-4-oxidanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[[6-[(4-fluorophenyl)methyl]-4-oxidanylidene-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[[6-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]sulfanyl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[6-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[[6-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]sulfanyl]acetamide Traditional Name: 2-[[6-(4-fluorobenzyl)-4-keto-5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidin-6-ium-2-yl]thio]-N-p-phenetyl-acetamide Formula: C24H26FN4O3S+ MolecularWeight: 469.551643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)CC[NH+](C3)CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)CC[NH+](C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C24H25FN4O3S/c1-2-32-19-9-7-18(8-10-19)26-22(30)15-33-24-27-21-11-12-29(14-20(21)23(31)28-24)13-16-3-5-17(25)6-4-16/h3-10H,2,11-15H2,1H3,(H,26,30)(H,27,28,31)/p+1