3-(1,3-benzodioxol-5-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[6-(4-morpholinylsulfonyl)-1,3-benzothiazol-2-yl]-2-propenamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)acrylamide Formula: C21H19N3O6S2 MolecularWeight: 473.52206

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C=CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O6S2/c25-20(6-2-14-1-5-17-18(11-14)30-13-29-17)23-21-22-16-4-3-15(12-19(16)31-21)32(26,27)24-7-9-28-10-8-24/h1-6,11-12H,7-10,13H2,(H,22,23,25)