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

Systemtic Name: N-(2-methylpropyl)-2-[[2-methylpropyl(3-phenylpropanoyl)amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-isobutyl-2-[[isobutyl(3-phenylpropanoyl)amino]methyl]thiazole-4-carboxamide CAS Name: N-(2-methylpropyl)-2-[[2-methylpropyl-(1-oxo-3-phenylpropyl)amino]methyl]-4-thiazolecarboxamide IUPAC Name: N-(2-methylpropyl)-2-[[2-methylpropyl(3-phenylpropanoyl)amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[hydrocinnamoyl(isobutyl)amino]methyl]-N-isobutyl-thiazole-4-carboxamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C1=CSC(=N1)CN(CC(C)C)C(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C22H31N3O2S/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/h5-9,15-17H,10-14H2,1-4H3,(H,23,27)