sodium 2-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: sodium 2-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: sodium 2-[2-(2,4-dichloroanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: sodium 2-[[2-(2,4-dichloroanilino)-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: sodium 2-[2-(2,4-dichloroanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: sodium 2-[[2-(2,4-dichloroanilino)-2-keto-ethyl]thio]nicotinate Formula: C14H9Cl2N2NaO3S MolecularWeight: 379.19363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C14H10Cl2N2O3S.Na/c15-8-3-4-11(10(16)6-8)18-12(19)7-22-13-9(14(20)21)2-1-5-17-13;/h1-6H,7H2,(H,18,19)(H,20,21);/q;+1/p-1