2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]pentanoic acid

Systemtic Name: 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]pentanoic acid Openeye Name: 2-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]pentanoic acid CAS Name: 2-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]pentanoic acid IUPAC Name: 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]pentanoic acid Traditional Name: 2-[[(E)-3-(2-thienyl)acryloyl]amino]valeric acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)C=CC1=CC=CS1

Isomeric SMILES

CCCC(C(=O)O)NC(=O)/C=C/C1=CC=CS1

InChI

InChI=1S/C12H15NO3S/c1-2-4-10(12(15)16)13-11(14)7-6-9-5-3-8-17-9/h3,5-8,10H,2,4H2,1H3,(H,13,14)(H,15,16)/b7-6+