(E)-2-cyano-3-[4-(diethylamino)phenyl]-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-(diethylamino)phenyl]-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(diethylamino)phenyl]-N-[3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(diethylamino)phenyl]-N-[3-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(diethylamino)phenyl]-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(diethylamino)phenyl]-N-(3-piperidinosulfonylphenyl)acrylamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C25H30N4O3S/c1-3-28(4-2)23-13-11-20(12-14-23)17-21(19-26)25(30)27-22-9-8-10-24(18-22)33(31,32)29-15-6-5-7-16-29/h8-14,17-18H,3-7,15-16H2,1-2H3,(H,27,30)/b21-17+