(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-benzyl-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acrylamide Formula: C18H22ClN3O MolecularWeight: 331.83978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3O/c1-3-4-12-22-18(19)16(14(2)21-22)10-11-17(23)20-13-15-8-6-5-7-9-15/h5-11H,3-4,12-13H2,1-2H3,(H,20,23)/b11-10+