1-(3-methylsulfonylpropyl)isoquinoline-3-carboxamide

Systemtic Name: 1-(3-methylsulfonylpropyl)isoquinoline-3-carboxamide Openeye Name: 1-(3-methylsulfonylpropyl)isoquinoline-3-carboxamide CAS Name: 1-(3-methylsulfonylpropyl)-3-isoquinolinecarboxamide IUPAC Name: 1-(3-methylsulfonylpropyl)isoquinoline-3-carboxamide Traditional Name: 1-(3-mesylpropyl)isoquinoline-3-carboxamide Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCC1=NC(=CC2=CC=CC=C21)C(=O)N

Isomeric SMILES

CS(=O)(=O)CCCC1=NC(=CC2=CC=CC=C21)C(=O)N

InChI

InChI=1S/C14H16N2O3S/c1-20(18,19)8-4-7-12-11-6-3-2-5-10(11)9-13(16-12)14(15)17/h2-3,5-6,9H,4,7-8H2,1H3,(H2,15,17)