N-(4-fluorophenyl)-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)pteridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-fluorophenyl)-2-[3-(3-isopropoxypropyl)-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(4-fluorophenyl)-2-[[4-oxo-3-(3-propan-2-yloxypropyl)-2-pteridinyl]thio]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-oxo-3-(3-propan-2-yloxypropyl)pteridin-2-yl]sulfanylacetamide Traditional Name: N-(4-fluorophenyl)-2-[[3-(3-isopropoxypropyl)-4-keto-pteridin-2-yl]thio]acetamide Formula: C20H22FN5O3S MolecularWeight: 431.483783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=NC=CN=C2N=C1SCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=NC=CN=C2N=C1SCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN5O3S/c1-13(2)29-11-3-10-26-19(28)17-18(23-9-8-22-17)25-20(26)30-12-16(27)24-15-6-4-14(21)5-7-15/h4-9,13H,3,10-12H2,1-2H3,(H,24,27)