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

Systemtic Name: (E)-4-[[5-(diethylcarbamoyl)-4-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[5-(diethylcarbamoyl)-3-isopropoxycarbonyl-4-methyl-2-thienyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[5-[diethylamino(oxo)methyl]-4-methyl-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[5-(diethylcarbamoyl)-4-methyl-3-propan-2-yloxycarbonylthiophen-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[5-(diethylcarbamoyl)-3-isopropoxycarbonyl-4-methyl-2-thienyl]amino]-4-keto-but-2-enoic acid Formula: C18H24N2O6S MolecularWeight: 396.45796

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C=CC(=O)O)C(=O)OC(C)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)/C=C/C(=O)O)C(=O)OC(C)C)C

InChI

InChI=1S/C18H24N2O6S/c1-6-20(7-2)17(24)15-11(5)14(18(25)26-10(3)4)16(27-15)19-12(21)8-9-13(22)23/h8-10H,6-7H2,1-5H3,(H,19,21)(H,22,23)/b9-8+