N-(2-cyanoethyl)-4-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-morpholinosulfonyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-(4-morpholinylsulfonyl)-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-morpholinosulfonyl-N-(3-pyridylmethyl)benzenesulfonamide Formula: C19H22N4O5S2 MolecularWeight: 450.53178

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CC3=CN=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CC3=CN=CC=C3

InChI

InChI=1S/C19H22N4O5S2/c20-8-2-10-23(16-17-3-1-9-21-15-17)30(26,27)19-6-4-18(5-7-19)29(24,25)22-11-13-28-14-12-22/h1,3-7,9,15H,2,10-14,16H2