3-[[5-methyl-2-(propanoylamino)thiophen-3-yl]carbonylamino]benzoate

Systemtic Name: 3-[[5-methyl-2-(propanoylamino)thiophen-3-yl]carbonylamino]benzoate Openeye Name: 3-[[5-methyl-2-(propanoylamino)thiophene-3-carbonyl]amino]benzoate CAS Name: 3-[[[5-methyl-2-(1-oxopropylamino)-3-thiophenyl]-oxomethyl]amino]benzoate IUPAC Name: 3-[[5-methyl-2-(propanoylamino)thiophene-3-carbonyl]amino]benzoate Traditional Name: 3-[(5-methyl-2-propionamido-thiophene-3-carbonyl)amino]benzoate Formula: C16H15N2O4S- MolecularWeight: 331.3663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(S1)C)C(=O)NC2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

CCC(=O)NC1=C(C=C(S1)C)C(=O)NC2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C16H16N2O4S/c1-3-13(19)18-15-12(7-9(2)23-15)14(20)17-11-6-4-5-10(8-11)16(21)22/h4-8H,3H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)/p-1