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

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(4-piperidinosulfonylbenzyl)acrylamide Formula: C23H31ClN4O3S MolecularWeight: 479.03524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C23H31ClN4O3S/c1-3-4-16-28-23(24)21(18(2)26-28)12-13-22(29)25-17-19-8-10-20(11-9-19)32(30,31)27-14-6-5-7-15-27/h8-13H,3-7,14-17H2,1-2H3,(H,25,29)/b13-12+