N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2-[(2-fluorophenyl)thio]-5-nitrobenzamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(2-fluorophenyl)thio]-5-nitro-benzamide Formula: C23H18FN3O4S MolecularWeight: 451.470123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4F

InChI

InChI=1S/C23H18FN3O4S/c24-19-6-1-2-7-21(19)32-20-11-10-17(27(30)31)13-18(20)23(29)26-16-5-3-4-14(12-16)22(28)25-15-8-9-15/h1-7,10-13,15H,8-9H2,(H,25,28)(H,26,29)