methyl 2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(pentanoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-(1-oxopentylamino)-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(pentanoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-(valerylamino)thiophene-3-carboxylic acid methyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H19NO3S/c1-3-4-10-14(19)18-16-15(17(20)21-2)13(11-22-16)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3,(H,18,19)