(E)-N-(3-piperidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(3-piperidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[3-(1-piperidylsulfonyl)phenyl]-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[3-(1-piperidinylsulfonyl)phenyl]-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(3-piperidin-1-ylsulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(3-piperidinosulfonylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)acrylamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O3S/c1-15-19(16(2)23(3)22-15)10-11-20(25)21-17-8-7-9-18(14-17)28(26,27)24-12-5-4-6-13-24/h7-11,14H,4-6,12-13H2,1-3H3,(H,21,25)/b11-10+