5-methyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 5-methyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 5-methyl-2-[[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-methyl-2-[[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-methyl-2-[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 5-methyl-2-[[(E)-3-(5-methyl-2-thienyl)acryloyl]amino]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C=CC2=CC=C(S2)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)/C=C/C2=CC=C(S2)C)C(=O)O

InChI

InChI=1S/C16H15NO3S/c1-10-3-7-14(13(9-10)16(19)20)17-15(18)8-6-12-5-4-11(2)21-12/h3-9H,1-2H3,(H,17,18)(H,19,20)/b8-6+