2-[2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]amino]-2-oxo-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[2-[[4-(2,5-dimethoxyphenyl)-2-thiazolyl]amino]-2-oxoethyl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[2-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]amino]-2-keto-ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C20H21N4O4S2- MolecularWeight: 445.53514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SCC(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)OC)OC)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)SCC(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)OC)OC)[O-]

InChI

InChI=1S/C20H22N4O4S2/c1-4-5-12-8-17(25)23-19(21-12)30-11-18(26)24-20-22-15(10-29-20)14-9-13(27-2)6-7-16(14)28-3/h6-10H,4-5,11H2,1-3H3,(H,21,23,25)(H,22,24,26)/p-1