2-(pentanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate

Systemtic Name: 2-(pentanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Openeye Name: 4-(4-isopropylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate CAS Name: 2-(1-oxopentylamino)-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylate IUPAC Name: 2-(pentanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Traditional Name: 4-p-cumenyl-2-(valerylamino)-3-thenoate Formula: C19H22NO3S- MolecularWeight: 344.44788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C(C)C)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C(C)C)C(=O)[O-]

InChI

InChI=1S/C19H23NO3S/c1-4-5-6-16(21)20-18-17(19(22)23)15(11-24-18)14-9-7-13(8-10-14)12(2)3/h7-12H,4-6H2,1-3H3,(H,20,21)(H,22,23)/p-1