3-(1,3-benzodioxol-5-yl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]prop-2-enamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]-2-propenamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)acrylamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C=CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O5S2/c26-21(9-5-15-4-8-18-19(12-15)30-14-29-18)24-22-23-17-7-6-16(13-20(17)31-22)32(27,28)25-10-2-1-3-11-25/h4-9,12-13H,1-3,10-11,14H2,(H,23,24,26)