N-(1-azanylpropan-2-yl)-1-oxidanylidene-2H-isoquinoline-5-sulfonamide

Systemtic Name: N-(1-azanylpropan-2-yl)-1-oxidanylidene-2H-isoquinoline-5-sulfonamide Openeye Name: N-(2-amino-1-methyl-ethyl)-1-oxo-2H-isoquinoline-5-sulfonamide CAS Name: N-(1-aminopropan-2-yl)-1-oxo-2H-isoquinoline-5-sulfonamide IUPAC Name: N-(1-aminopropan-2-yl)-1-oxo-2H-isoquinoline-5-sulfonamide Traditional Name: N-(2-amino-1-methyl-ethyl)-1-keto-2H-isoquinoline-5-sulfonamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)NS(=O)(=O)C1=CC=CC2=C1C=CNC2=O

Isomeric SMILES

CC(CN)NS(=O)(=O)C1=CC=CC2=C1C=CNC2=O

InChI

InChI=1S/C12H15N3O3S/c1-8(7-13)15-19(17,18)11-4-2-3-10-9(11)5-6-14-12(10)16/h2-6,8,15H,7,13H2,1H3,(H,14,16)