N-[4-(4-butylphenyl)-3-cyano-thiophen-2-yl]-6-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(4-butylphenyl)-3-cyano-thiophen-2-yl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[4-(4-butylphenyl)-3-cyano-2-thienyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[4-(4-butylphenyl)-3-cyano-2-thiophenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[4-(4-butylphenyl)-3-cyanothiophen-2-yl]-6-chloropyridine-3-carboxamide Traditional Name: N-[4-(4-butylphenyl)-3-cyano-2-thienyl]-6-chloro-nicotinamide Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C21H18ClN3OS/c1-2-3-4-14-5-7-15(8-6-14)18-13-27-21(17(18)11-23)25-20(26)16-9-10-19(22)24-12-16/h5-10,12-13H,2-4H2,1H3,(H,25,26)