(E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: (E)-3-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-N-[4-(1H-pyrrol-2-yl)thiazol-2-yl]prop-2-enamide CAS Name: (E)-3-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-N-[4-(1H-pyrrol-2-yl)-2-thiazolyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-N-[4-(1H-pyrrol-2-yl)-1,3-thiazol-2-yl]prop-2-enamide Traditional Name: (E)-3-(4-methoxy-3-piperidinosulfonyl-phenyl)-N-[4-(1H-pyrrol-2-yl)thiazol-2-yl]acrylamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=NC(=CS2)C3=CC=CN3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=NC(=CS2)C3=CC=CN3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H24N4O4S2/c1-30-19-9-7-16(14-20(19)32(28,29)26-12-3-2-4-13-26)8-10-21(27)25-22-24-18(15-31-22)17-6-5-11-23-17/h5-11,14-15,23H,2-4,12-13H2,1H3,(H,24,25,27)/b10-8+