N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(phenylsulfonyl)furan-2-yl]prop-2-enamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(phenylsulfonyl)furan-2-yl]prop-2-enamide Openeye Name: 3-[5-(benzenesulfonyl)-2-furyl]-N-(1,3-benzothiazol-2-yl)-2-cyano-prop-2-enamide CAS Name: 3-[5-(benzenesulfonyl)-2-furanyl]-N-(1,3-benzothiazol-2-yl)-2-cyano-2-propenamide IUPAC Name: 3-[5-(benzenesulfonyl)furan-2-yl]-N-(1,3-benzothiazol-2-yl)-2-cyanoprop-2-enamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(5-besyl-2-furyl)-2-cyano-acrylamide Formula: C21H13N3O4S2 MolecularWeight: 435.47562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C=C(C#N)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C=C(C#N)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H13N3O4S2/c22-13-14(20(25)24-21-23-17-8-4-5-9-18(17)29-21)12-15-10-11-19(28-15)30(26,27)16-6-2-1-3-7-16/h1-12H,(H,23,24,25)