1-(5-chloranylthiophen-2-yl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-anilino-1-(5-chloro-2-thienyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-thioxo-prop-1-en-1-olate CAS Name: 3-anilino-1-(5-chloro-2-thiophenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-anilino-1-(5-chlorothiophen-2-yl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-anilino-1-(5-chloro-2-thienyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-thioxo-prop-1-en-1-olate Formula: C20H18ClN3OS2 MolecularWeight: 415.95942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3OS2/c1-23(2)15-10-12-24(13-11-15)18(19(25)16-8-9-17(21)27-16)20(26)22-14-6-4-3-5-7-14/h3-13H,1-2H3,(H-,22,25,26)