2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)butanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]sulfanyl]-N-(2,3-dimethylphenyl)butanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-(2,3-dimethylphenyl)butanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]thio]-N-(2,3-dimethylphenyl)butyramide Formula: C23H21N5OS2 MolecularWeight: 447.57574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1C)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1C)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

InChI

InChI=1S/C23H21N5OS2/c1-4-18(22(29)27-17-8-5-7-13(2)14(17)3)31-23-16(12-25)20(19-9-6-10-30-19)15(11-24)21(26)28-23/h5-10,18H,4H2,1-3H3,(H2,26,28)(H,27,29)