N-(1-adamantyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[3-(2-methoxyethyl)-4-oxo-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[[4-keto-3-(2-methoxyethyl)pyrido[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H28N4O3S/c1-29-6-5-26-20(28)17-3-2-4-23-19(17)24-21(26)30-13-18(27)25-22-10-14-7-15(11-22)9-16(8-14)12-22/h2-4,14-16H,5-13H2,1H3,(H,25,27)