N-[1-[methyl-(phenylmethyl)amino]butan-2-yl]-2-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: N-[1-[methyl-(phenylmethyl)amino]butan-2-yl]-2-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: N-[1-[[benzyl(methyl)amino]methyl]propyl]-2-oxo-1H-quinoline-6-sulfonamide CAS Name: N-[1-[methyl-(phenylmethyl)amino]butan-2-yl]-2-oxo-1H-quinoline-6-sulfonamide IUPAC Name: N-[1-[benzyl(methyl)amino]butan-2-yl]-2-oxo-1H-quinoline-6-sulfonamide Traditional Name: N-[1-[[benzyl(methyl)amino]methyl]propyl]-2-keto-1H-quinoline-6-sulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(C)CC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3

Isomeric SMILES

CCC(CN(C)CC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3

InChI

InChI=1S/C21H25N3O3S/c1-3-18(15-24(2)14-16-7-5-4-6-8-16)23-28(26,27)19-10-11-20-17(13-19)9-12-21(25)22-20/h4-13,18,23H,3,14-15H2,1-2H3,(H,22,25)