N-[6-azanyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide

Systemtic Name: N-[6-azanyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Openeye Name: N-[6-amino-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-ethoxy-benzamide CAS Name: N-[6-amino-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-[6-amino-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-ethoxybenzamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C22H22N4O5S/c1-3-31-16-10-6-14(7-11-16)20(28)24-18-19(23)25-22(26-21(18)29)32-12-17(27)13-4-8-15(30-2)9-5-13/h4-11H,3,12H2,1-2H3,(H,24,28)(H3,23,25,26,29)