2-[3-(2-methylpropyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[3-(2-methylpropyl)-4-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(3-isobutyl-4-oxo-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-pyrido[2,3-d]pyrimidinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[3-(2-methylpropyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[(3-isobutyl-4-keto-pyrido[2,3-d]pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(N=CC=C2)N=C1SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-15(2)13-25-20(27)17-9-6-11-23-19(17)24-21(25)28-14-18(26)22-12-10-16-7-4-3-5-8-16/h3-9,11,15H,10,12-14H2,1-2H3,(H,22,26)