(E)-3-naphthalen-1-yl-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate

Systemtic Name: (E)-3-naphthalen-1-yl-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-3-(1-naphthyl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(1-naphthalenyl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-naphthalen-1-yl-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(1-naphthyl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acrylate Formula: C21H18NO4S2- MolecularWeight: 412.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)C(=CC3=CC=CC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)/C(=C/C3=CC=CC4=CC=CC=C43)/C(=O)[O-]

InChI

InChI=1S/C21H19NO4S2/c23-21(24)18(14-16-8-5-7-15-6-1-2-9-17(15)16)19-10-11-20(27-19)28(25,26)22-12-3-4-13-22/h1-2,5-11,14H,3-4,12-13H2,(H,23,24)/p-1/b18-14-