2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]ethanamide

Systemtic Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]ethanamide Openeye Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C23H16FN5O4S MolecularWeight: 477.467643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)F

InChI

InChI=1S/C23H16FN5O4S/c24-15-7-5-14(6-8-15)21-18-3-1-2-4-19(18)22(28-27-21)34-13-20(30)26-23(31)25-16-9-11-17(12-10-16)29(32)33/h1-12H,13H2,(H2,25,26,30,31)