(E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-benzofuran-5-yl)but-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-5-benzofuranyl)-2-butenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-1-benzofuran-5-yl)but-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(6-methoxy-2,3-dimethyl-benzofuran-5-yl)but-2-enamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC(=C(C=C12)C(=CC(=O)NC3=NC4=CC=CC=C4S3)C)OC)C

Isomeric SMILES

CC1=C(OC2=CC(=C(C=C12)/C(=C/C(=O)NC3=NC4=CC=CC=C4S3)/C)OC)C

InChI

InChI=1S/C22H20N2O3S/c1-12(9-21(25)24-22-23-17-7-5-6-8-20(17)28-22)15-10-16-13(2)14(3)27-19(16)11-18(15)26-4/h5-11H,1-4H3,(H,23,24,25)/b12-9+