6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-(2-methoxyethyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-4-keto-N-(2-methoxyethyl)-1H-quinoline-3-carboxamide Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COCCNC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O5S/c1-27-11-8-20-19(24)16-13-21-17-7-6-14(12-15(17)18(16)23)28(25,26)22-9-4-2-3-5-10-22/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,24)(H,21,23)