4-[[(5-methyl-4-propyl-thiophen-2-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(5-methyl-4-propyl-thiophen-2-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(5-methyl-4-propyl-thiophene-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(5-methyl-4-propyl-2-thiophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(5-methyl-4-propylthiophene-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(5-methyl-4-propyl-thiophene-2-carbonyl)amino]methyl]benzoic acid Formula: C17H19NO3S MolecularWeight: 317.40266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C

InChI

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