5-(butanoylamino)-4-cyano-N-(2,3-dimethylphenyl)-3-methyl-thiophene-2-carboxamide

Systemtic Name: 5-(butanoylamino)-4-cyano-N-(2,3-dimethylphenyl)-3-methyl-thiophene-2-carboxamide Openeye Name: 5-(butanoylamino)-4-cyano-N-(2,3-dimethylphenyl)-3-methyl-thiophene-2-carboxamide CAS Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-(1-oxobutylamino)-2-thiophenecarboxamide IUPAC Name: 5-(butanoylamino)-4-cyano-N-(2,3-dimethylphenyl)-3-methylthiophene-2-carboxamide Traditional Name: 5-butyramido-4-cyano-N-(2,3-dimethylphenyl)-3-methyl-thiophene-2-carboxamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2C)C)C)C#N

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2=CC=CC(=C2C)C)C)C#N

InChI

InChI=1S/C19H21N3O2S/c1-5-7-16(23)22-19-14(10-20)13(4)17(25-19)18(24)21-15-9-6-8-11(2)12(15)3/h6,8-9H,5,7H2,1-4H3,(H,21,24)(H,22,23)