N-[3-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]phenyl]oxolane-2-carboxamide

Systemtic Name: N-[3-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]phenyl]oxolane-2-carboxamide Openeye Name: N-[3-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)phenyl]tetrahydrofuran-2-carboxamide CAS Name: N-[3-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]-2-oxolanecarboxamide IUPAC Name: N-[3-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)phenyl]oxolane-2-carboxamide Traditional Name: N-[3-(4-mesyl-1,4-diazepane-1-carbonyl)phenyl]tetrahydrofuran-2-carboxamide Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCCO3

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCCO3

InChI

InChI=1S/C18H25N3O5S/c1-27(24,25)21-9-4-8-20(10-11-21)18(23)14-5-2-6-15(13-14)19-17(22)16-7-3-12-26-16/h2,5-6,13,16H,3-4,7-12H2,1H3,(H,19,22)