(E)-3-(4-methylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate

Systemtic Name: (E)-3-(4-methylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-2-[5-(1-piperidylsulfonyl)-2-thienyl]-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-(4-methylphenyl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-2-(5-piperidinosulfonyl-2-thienyl)-3-(p-tolyl)acrylate Formula: C19H20NO4S2- MolecularWeight: 390.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C2=CC=C(S2)S(=O)(=O)N3CCCCC3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(/C2=CC=C(S2)S(=O)(=O)N3CCCCC3)\C(=O)[O-]

InChI

InChI=1S/C19H21NO4S2/c1-14-5-7-15(8-6-14)13-16(19(21)22)17-9-10-18(25-17)26(23,24)20-11-3-2-4-12-20/h5-10,13H,2-4,11-12H2,1H3,(H,21,22)/p-1/b16-13-