3-[(2-ethoxyphenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanyl-1-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: 3-[(2-ethoxyphenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanyl-1-thiophen-2-yl-prop-2-en-1-one Openeye Name: 3-(2-ethoxyanilino)-2-pyridin-1-ium-1-yl-3-sulfanyl-1-(2-thienyl)prop-2-en-1-one CAS Name: 3-(2-ethoxyanilino)-3-mercapto-2-(1-pyridin-1-iumyl)-1-thiophen-2-yl-2-propen-1-one IUPAC Name: 3-(2-ethoxyanilino)-2-pyridin-1-ium-1-yl-3-sulfanyl-1-thiophen-2-ylprop-2-en-1-one Traditional Name: 3-mercapto-3-(o-phenetidino)-2-pyridin-1-ium-1-yl-1-(2-thienyl)prop-2-en-1-one Formula: C20H19N2O2S2+ MolecularWeight: 383.50706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=C(C(=O)C2=CC=CS2)[N+]3=CC=CC=C3)S

Isomeric SMILES

CCOC1=CC=CC=C1NC(=C(C(=O)C2=CC=CS2)[N+]3=CC=CC=C3)S

InChI

InChI=1S/C20H18N2O2S2/c1-2-24-16-10-5-4-9-15(16)21-20(25)18(22-12-6-3-7-13-22)19(23)17-11-8-14-26-17/h3-14H,2H2,1H3,(H-,21,23,25)/p+1