(E)-2-cyano-3-(2-methyl-1,3-thiazol-4-yl)-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2-methyl-1,3-thiazol-4-yl)-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2-methylthiazol-4-yl)-N-[3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2-methyl-4-thiazolyl)-N-[3-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(2-methyl-1,3-thiazol-4-yl)-N-(3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2-methylthiazol-4-yl)-N-(3-piperidinosulfonylphenyl)acrylamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20N4O3S2/c1-14-21-17(13-27-14)10-15(12-20)19(24)22-16-6-5-7-18(11-16)28(25,26)23-8-3-2-4-9-23/h5-7,10-11,13H,2-4,8-9H2,1H3,(H,22,24)/b15-10+