2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-1-ium-2-yl)sulfanyl-N-(4-chlorophenyl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-1-ium-2-yl)sulfanyl-N-(4-chlorophenyl)ethanamide Openeye Name: 2-[6-amino-3,5-dicyano-4-(2-thienyl)pyridin-1-ium-2-yl]sulfanyl-N-(4-chlorophenyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridin-1-iumyl)thio]-N-(4-chlorophenyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-1-ium-2-yl)sulfanyl-N-(4-chlorophenyl)acetamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)pyridin-1-ium-2-yl]thio]-N-(4-chlorophenyl)acetamide Formula: C19H13ClN5OS2+ MolecularWeight: 426.92242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(C(=[NH+]C(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Cl)N)C#N

Isomeric SMILES

C1=CSC(=C1)C2=C(C(=[NH+]C(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Cl)N)C#N

InChI

InChI=1S/C19H12ClN5OS2/c20-11-3-5-12(6-4-11)24-16(26)10-28-19-14(9-22)17(15-2-1-7-27-15)13(8-21)18(23)25-19/h1-7H,10H2,(H2,23,25)(H,24,26)/p+1