(E)-N-[(2S)-5-methylhexan-2-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[(2S)-5-methylhexan-2-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[(1S)-1,4-dimethylpentyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[(2S)-5-methylhexan-2-yl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[(2S)-5-methylhexan-2-yl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[(1S)-1,4-dimethylpentyl]-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C=CC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C19H25N3O/c1-15(2)9-10-16(3)21-19(23)12-11-17-13-20-22(14-17)18-7-5-4-6-8-18/h4-8,11-16H,9-10H2,1-3H3,(H,21,23)/b12-11+/t16-/m0/s1