N-ethyl-3-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]benzamide CAS Name: N-ethyl-3-[[2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetyl]amino]benzamide Formula: C25H21FN4O2S MolecularWeight: 460.523243

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN4O2S/c1-2-27-24(32)17-6-5-7-19(14-17)28-22(31)15-33-25-21-9-4-3-8-20(21)23(29-30-25)16-10-12-18(26)13-11-16/h3-14H,2,15H2,1H3,(H,27,32)(H,28,31)