N-[3-(cyclopropylcarbamoyl)phenyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C21H22FN3O5S MolecularWeight: 447.479883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

InChI

InChI=1S/C21H22FN3O5S/c22-19-7-6-17(31(28,29)25-8-10-30-11-9-25)13-18(19)21(27)24-16-3-1-2-14(12-16)20(26)23-15-4-5-15/h1-3,6-7,12-13,15H,4-5,8-11H2,(H,23,26)(H,24,27)