N-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[(2R)-2-(4-morpholinyl)-2-(3-pyridinyl)ethyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-1,3-benzodioxole-5-sulfonamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNS(=O)(=O)C2=CC3=C(C=C2)OCO3)C4=CN=CC=C4

Isomeric SMILES

C1COCCN1[C@@H](CNS(=O)(=O)C2=CC3=C(C=C2)OCO3)C4=CN=CC=C4

InChI

InChI=1S/C18H21N3O5S/c22-27(23,15-3-4-17-18(10-15)26-13-25-17)20-12-16(14-2-1-5-19-11-14)21-6-8-24-9-7-21/h1-5,10-11,16,20H,6-9,12-13H2/t16-/m0/s1