N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanamide

Systemtic Name: N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanamide Openeye Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]-2-(4-methyl-2-oxo-1-quinolyl)butanamide CAS Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thiophenyl]-2-(4-methyl-2-oxo-1-quinolinyl)butanamide IUPAC Name: N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-2-(4-methyl-2-oxoquinolin-1-yl)butanamide Traditional Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]-2-(2-keto-4-methyl-1-quinolyl)butyramide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C#N)N3C4=CC=CC=C4C(=CC3=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C#N)N3C4=CC=CC=C4C(=CC3=O)C

InChI

InChI=1S/C26H23N3O3S/c1-4-22(29-23-8-6-5-7-19(23)16(2)13-24(29)30)25(31)28-26-20(14-27)21(15-33-26)17-9-11-18(32-3)12-10-17/h5-13,15,22H,4H2,1-3H3,(H,28,31)