N-[2-[cyclohexyl(methyl)amino]ethyl]-1-oxidanylidene-2H-isoquinoline-5-sulfonamide

Systemtic Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-1-oxidanylidene-2H-isoquinoline-5-sulfonamide Openeye Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-1-oxo-2H-isoquinoline-5-sulfonamide CAS Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-1-oxo-2H-isoquinoline-5-sulfonamide IUPAC Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-1-oxo-2H-isoquinoline-5-sulfonamide Traditional Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-1-keto-2H-isoquinoline-5-sulfonamide Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNS(=O)(=O)C1=CC=CC2=C1C=CNC2=O)C3CCCCC3

Isomeric SMILES

CN(CCNS(=O)(=O)C1=CC=CC2=C1C=CNC2=O)C3CCCCC3

InChI

InChI=1S/C18H25N3O3S/c1-21(14-6-3-2-4-7-14)13-12-20-25(23,24)17-9-5-8-16-15(17)10-11-19-18(16)22/h5,8-11,14,20H,2-4,6-7,12-13H2,1H3,(H,19,22)