(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[1-(p-tolylsulfonyl)-4-piperidyl]prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(1-tosyl-4-piperidyl)acrylamide Formula: C23H31ClN4O3S MolecularWeight: 479.03524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)Cl

InChI

InChI=1S/C23H31ClN4O3S/c1-4-5-14-28-23(24)21(18(3)26-28)10-11-22(29)25-19-12-15-27(16-13-19)32(30,31)20-8-6-17(2)7-9-20/h6-11,19H,4-5,12-16H2,1-3H3,(H,25,29)/b11-10+