3-[6-azanyl-3,5-dicyano-4-(furan-2-yl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(furan-2-yl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(2-furyl)-2-pyridyl]sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(2-furanyl)-2-pyridinyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(furan-2-yl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(2-furyl)-2-pyridyl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C20H16N6O4S2 MolecularWeight: 468.50884

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

Isomeric SMILES

C1=COC(=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

InChI

InChI=1S/C20H16N6O4S2/c21-10-14-18(16-2-1-8-30-16)15(11-22)20(26-19(14)23)31-9-7-17(27)25-12-3-5-13(6-4-12)32(24,28)29/h1-6,8H,7,9H2,(H2,23,26)(H,25,27)(H2,24,28,29)