2-[2-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[2-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-4-oxo-thieno[3,2-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[2-[[2-(2,4-dimethoxyanilino)-2-oxoethyl]thio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]acetic acid IUPAC Name: 2-[2-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[2-[[2-(2,4-dimethoxyanilino)-2-keto-ethyl]thio]-4-keto-thieno[3,2-d]pyrimidin-3-yl]acetic acid Formula: C18H17N3O6S2 MolecularWeight: 435.47408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC(=O)O)SC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC(=O)O)SC=C3)OC

InChI

InChI=1S/C18H17N3O6S2/c1-26-10-3-4-11(13(7-10)27-2)19-14(22)9-29-18-20-12-5-6-28-16(12)17(25)21(18)8-15(23)24/h3-7H,8-9H2,1-2H3,(H,19,22)(H,23,24)