(E)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-phenyl-acrylamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C=CC2=CC=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24N2O4S/c1-2-27-19-12-11-18(16-20(19)28(25,26)23-14-6-7-15-23)22-21(24)13-10-17-8-4-3-5-9-17/h3-5,8-13,16H,2,6-7,14-15H2,1H3,(H,22,24)/b13-10+