5-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Openeye Name: 2-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylic acid CAS Name: 5-methyl-2-[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Traditional Name: 5-methyl-2-[[(E)-3-p-cumenylacryloyl]amino]-3-thenoic acid Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)/C=C/C2=CC=C(C=C2)C(C)C)C(=O)O

InChI

InChI=1S/C18H19NO3S/c1-11(2)14-7-4-13(5-8-14)6-9-16(20)19-17-15(18(21)22)10-12(3)23-17/h4-11H,1-3H3,(H,19,20)(H,21,22)/b9-6+