4-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 4-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-[[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 4-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H21N3O4S/c1-2-13-23-30(27,28)18-11-9-16(10-12-18)22(26)25-14-5-6-17(15-25)21-24-19-7-3-4-8-20(19)29-21/h1,3-4,7-12,17,23H,5-6,13-15H2