3-[2-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[2-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[2-[2-[(3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl]sulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid CAS Name: 3-[2-[[2-[(3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl]thio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 3-[2-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]sulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-[[2-[(3-carbethoxy-2-thienyl)amino]-2-keto-ethyl]thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]propionic acid Formula: C17H19N3O6S2 MolecularWeight: 425.47926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CSC2=NC(=O)C(=C(N2)C)CCC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CSC2=NC(=O)C(=C(N2)C)CCC(=O)O

InChI

InChI=1S/C17H19N3O6S2/c1-3-26-16(25)11-6-7-27-15(11)19-12(21)8-28-17-18-9(2)10(14(24)20-17)4-5-13(22)23/h6-7H,3-5,8H2,1-2H3,(H,19,21)(H,22,23)(H,18,20,24)