1-[2,5-bis(chloranyl)phenyl]-2-(4-tert-butylpyridin-1-ium-1-yl)-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-2-(4-tert-butylpyridin-1-ium-1-yl)-3-phenylazanyl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(2,5-dichlorophenyl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-anilino-2-(4-tert-butyl-1-pyridin-1-iumyl)-1-(2,5-dichlorophenyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(2,5-dichlorophenyl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-anilino-2-(4-tert-butylpyridin-1-ium-1-yl)-1-(2,5-dichlorophenyl)-3-thioxo-prop-1-en-1-olate Formula: C24H22Cl2N2OS MolecularWeight: 457.41528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22Cl2N2OS/c1-24(2,3)16-11-13-28(14-12-16)21(23(30)27-18-7-5-4-6-8-18)22(29)19-15-17(25)9-10-20(19)26/h4-15H,1-3H3,(H-,27,29,30)