(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)acrylamide Formula: C22H29ClN4O5S MolecularWeight: 497.00746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC)Cl

InChI

InChI=1S/C22H29ClN4O5S/c1-4-5-10-27-22(23)18(16(2)25-27)7-9-21(28)24-19-15-17(6-8-20(19)31-3)33(29,30)26-11-13-32-14-12-26/h6-9,15H,4-5,10-14H2,1-3H3,(H,24,28)/b9-7+