(E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methylpropyl]-3-(1-methyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methylpropyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(1-methylpyrazol-4-yl)acrylamide Formula: C21H29N3O MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C=CC2=CN(N=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O/c1-15(2)20(17-8-10-18(11-9-17)21(3,4)5)23-19(25)12-7-16-13-22-24(6)14-16/h7-15,20H,1-6H3,(H,23,25)/b12-7+/t20-/m0/s1