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

Systemtic Name: N-cyclopropyl-2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetyl]amino]benzamide Formula: C26H21FN4O2S MolecularWeight: 472.533943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H21FN4O2S/c27-17-11-9-16(10-12-17)24-19-5-1-2-6-20(19)26(31-30-24)34-15-23(32)29-22-8-4-3-7-21(22)25(33)28-18-13-14-18/h1-12,18H,13-15H2,(H,28,33)(H,29,32)