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

Systemtic Name: (E)-3-(2-methylphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-3-(o-tolyl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(2-methylphenyl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-(2-methylphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(o-tolyl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acrylate Formula: C18H18NO4S2- MolecularWeight: 376.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C2=CC=C(S2)S(=O)(=O)N3CCCC3)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1/C=C(/C2=CC=C(S2)S(=O)(=O)N3CCCC3)\C(=O)[O-]

InChI

InChI=1S/C18H19NO4S2/c1-13-6-2-3-7-14(13)12-15(18(20)21)16-8-9-17(24-16)25(22,23)19-10-4-5-11-19/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,20,21)/p-1/b15-12-