4-methyl-2-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[(E)-3-(3-methyl-2-thienyl)prop-2-enoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[(E)-3-(3-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[(E)-3-(3-methyl-2-thienyl)acryloyl]amino]valeric acid Formula: C14H19NO3S MolecularWeight: 281.37056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=CC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)/C=C/C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C14H19NO3S/c1-9(2)8-11(14(17)18)15-13(16)5-4-12-10(3)6-7-19-12/h4-7,9,11H,8H2,1-3H3,(H,15,16)(H,17,18)/b5-4+