2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[[cyclopropyl-[1-(2-fluorophenyl)ethyl]amino]methyl]-4-(2-thienyl)phthalazin-1-one Formula: C24H22FN3OS MolecularWeight: 419.514383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)N(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)C5CC5

Isomeric SMILES

CC(C1=CC=CC=C1F)N(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)C5CC5

InChI

InChI=1S/C24H22FN3OS/c1-16(18-7-4-5-10-21(18)25)27(17-12-13-17)15-28-24(29)20-9-3-2-8-19(20)23(26-28)22-11-6-14-30-22/h2-11,14,16-17H,12-13,15H2,1H3