1-(5-chloranylthiophen-2-yl)-3-(furan-2-ylmethylamino)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-3-(furan-2-ylmethylamino)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-(5-chloro-2-thienyl)-3-(2-furylmethylamino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 1-(5-chloro-2-thiophenyl)-3-(2-furanylmethylamino)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-(5-chlorothiophen-2-yl)-3-(furan-2-ylmethylamino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(5-chloro-2-thienyl)-3-(2-furfurylamino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C17H13ClN2O2S2 MolecularWeight: 376.88032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NCC3=CC=CO3

Isomeric SMILES

C1=CC=[N+](C=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NCC3=CC=CO3

InChI

InChI=1S/C17H13ClN2O2S2/c18-14-7-6-13(24-14)16(21)15(20-8-2-1-3-9-20)17(23)19-11-12-5-4-10-22-12/h1-10H,11H2,(H-,19,21,23)