1-[2-[3-(4-methoxyphenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[3-(4-methoxyphenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[3-(4-methoxyphenyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[3-(4-methoxyphenyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[3-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[4-keto-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-2-yl]thio]acetyl]isonipecotamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C21H22N4O4S2/c1-29-15-4-2-14(3-5-15)25-20(28)18-16(8-11-30-18)23-21(25)31-12-17(26)24-9-6-13(7-10-24)19(22)27/h2-5,8,11,13H,6-7,9-10,12H2,1H3,(H2,22,27)