N-(2-methylpropyl)-2-[[2-methylpropyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-2-[[2-methylpropyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-isobutyl-2-[[isobutyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]thiazole-4-carboxamide CAS Name: N-(2-methylpropyl)-2-[[2-methylpropyl-[(E)-1-oxo-3-phenylprop-2-enyl]amino]methyl]-4-thiazolecarboxamide IUPAC Name: N-(2-methylpropyl)-2-[[2-methylpropyl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-isobutyl-2-[[isobutyl-[(E)-3-phenylacryloyl]amino]methyl]thiazole-4-carboxamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H29N3O2S/c1-16(2)12-23-22(27)19-15-28-20(24-19)14-25(13-17(3)4)21(26)11-10-18-8-6-5-7-9-18/h5-11,15-17H,12-14H2,1-4H3,(H,23,27)/b11-10+