N-[3-(azepan-1-ylsulfonyl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-keto-3,4-dihydro-1H-quinoline-6-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)NC(=O)CC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC4=C(C=C3)NC(=O)CC4

InChI

InChI=1S/C22H25N3O4S/c26-21-11-9-16-14-17(8-10-20(16)24-21)22(27)23-18-6-5-7-19(15-18)30(28,29)25-12-3-1-2-4-13-25/h5-8,10,14-15H,1-4,9,11-13H2,(H,23,27)(H,24,26)