(E)-3-[4-(2-thiophen-2-ylsulfanylethanoylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-thiophen-2-ylsulfanylethanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[2-(2-thienylsulfanyl)acetyl]amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[1-oxo-2-(thiophen-2-ylthio)ethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(2-thiophen-2-ylsulfanylacetyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[2-(2-thienylthio)acetyl]amino]phenyl]acrylic acid Formula: C15H13NO3S2 MolecularWeight: 319.39862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)SCC(=O)NC2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1=CSC(=C1)SCC(=O)NC2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C15H13NO3S2/c17-13(10-21-15-2-1-9-20-15)16-12-6-3-11(4-7-12)5-8-14(18)19/h1-9H,10H2,(H,16,17)(H,18,19)/b8-5+