(E)-4-[(3-aminocarbonyl-5-propan-2-yl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-aminocarbonyl-5-propan-2-yl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3-carbamoyl-5-isopropyl-2-thienyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3-carbamoyl-5-propan-2-yl-2-thiophenyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3-carbamoyl-5-propan-2-ylthiophen-2-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3-carbamoyl-5-isopropyl-2-thienyl)amino]-4-keto-but-2-enoic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C=CC(=O)O)C(=O)N

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)/C=C/C(=O)O)C(=O)N

InChI

InChI=1S/C12H14N2O4S/c1-6(2)8-5-7(11(13)18)12(19-8)14-9(15)3-4-10(16)17/h3-6H,1-2H3,(H2,13,18)(H,14,15)(H,16,17)/b4-3+