(E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-methylsulfonylpropyl)prop-2-enamide

Systemtic Name: (E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-methylsulfonylpropyl)prop-2-enamide Openeye Name: (E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-methylsulfonylpropyl)prop-2-enamide CAS Name: (E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-methylsulfonylpropyl)-2-propenamide IUPAC Name: (E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-methylsulfonylpropyl)prop-2-enamide Traditional Name: (E)-N-(2,3-dimethoxyphenyl)-3-(1H-indazol-3-yl)-N-(3-mesylpropyl)acrylamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)N(CCCS(=O)(=O)C)C(=O)C=CC2=NNC3=CC=CC=C32

Isomeric SMILES

COC1=CC=CC(=C1OC)N(CCCS(=O)(=O)C)C(=O)/C=C/C2=NNC3=CC=CC=C32

InChI

InChI=1S/C22H25N3O5S/c1-29-20-11-6-10-19(22(20)30-2)25(14-7-15-31(3,27)28)21(26)13-12-18-16-8-4-5-9-17(16)23-24-18/h4-6,8-13H,7,14-15H2,1-3H3,(H,23,24)/b13-12+