N-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]isoquinoline-5-sulfonamide Openeye Name: N-methyl-N-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]isoquinoline-5-sulfonamide CAS Name: N-methyl-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-5-isoquinolinesulfonamide IUPAC Name: N-methyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-keto-2-(4-methylpiperidino)ethyl]-N-methyl-isoquinoline-5-sulfonamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C18H23N3O3S/c1-14-7-10-21(11-8-14)18(22)13-20(2)25(23,24)17-5-3-4-15-12-19-9-6-16(15)17/h3-6,9,12,14H,7-8,10-11,13H2,1-2H3