3-[5-methyl-4-[(Z)-C-methyl-N-(2-thiophen-2-ylethanoylamino)carbonimidoyl]furan-2-yl]propanoic acid

Systemtic Name: 3-[5-methyl-4-[(Z)-C-methyl-N-(2-thiophen-2-ylethanoylamino)carbonimidoyl]furan-2-yl]propanoic acid Openeye Name: 3-[5-methyl-4-[(Z)-C-methyl-N-[[2-(2-thienyl)acetyl]amino]carbonimidoyl]-2-furyl]propanoic acid CAS Name: 3-[5-methyl-4-[(1Z)-1-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]ethyl]-2-furanyl]propanoic acid IUPAC Name: 3-[5-methyl-4-[(Z)-C-methyl-N-[(2-thiophen-2-ylacetyl)amino]carbonimidoyl]furan-2-yl]propanoic acid Traditional Name: 3-[5-methyl-4-[(Z)-C-methyl-N-[[2-(2-thienyl)acetyl]amino]carbonimidoyl]-2-furyl]propionic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)O)C(=NNC(=O)CC2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)O)/C(=N\NC(=O)CC2=CC=CS2)/C

InChI

InChI=1S/C16H18N2O4S/c1-10(17-18-15(19)9-13-4-3-7-23-13)14-8-12(22-11(14)2)5-6-16(20)21/h3-4,7-8H,5-6,9H2,1-2H3,(H,18,19)(H,20,21)/b17-10-