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

Systemtic Name: (E)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-3-pyridin-4-yl-prop-2-enoate Openeye Name: (E)-2-[5-(1-piperidylsulfonyl)-2-thienyl]-3-(4-pyridyl)prop-2-enoate CAS Name: (E)-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]-3-pyridin-4-yl-2-propenoate IUPAC Name: (E)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)-3-pyridin-4-ylprop-2-enoate Traditional Name: (E)-2-(5-piperidinosulfonyl-2-thienyl)-3-(4-pyridyl)acrylate Formula: C17H17N2O4S2- MolecularWeight: 377.45788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C(=CC3=CC=NC=C3)C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)/C(=C/C3=CC=NC=C3)/C(=O)[O-]

InChI

InChI=1S/C17H18N2O4S2/c20-17(21)14(12-13-6-8-18-9-7-13)15-4-5-16(24-15)25(22,23)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,20,21)/p-1/b14-12-