ethyl 2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(butanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-(1-oxobutylamino)-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(butanoylamino)-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-butyramido-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H21NO3S/c1-4-9-14(20)19-17-16(18(21)22-5-2)15(12(3)23-17)13-10-7-6-8-11-13/h6-8,10-11H,4-5,9H2,1-3H3,(H,19,20)