2-butyl-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-butyl-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-butyl-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiazole-5-carboxamide CAS Name: 2-butyl-4-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-5-thiazolecarboxamide IUPAC Name: 2-butyl-4-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-butyl-N-[3-(isobutyrylamino)benzyl]-4-methyl-thiazole-5-carboxamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(S1)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)C

Isomeric SMILES

CCCCC1=NC(=C(S1)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)C

InChI

InChI=1S/C20H27N3O2S/c1-5-6-10-17-22-14(4)18(26-17)20(25)21-12-15-8-7-9-16(11-15)23-19(24)13(2)3/h7-9,11,13H,5-6,10,12H2,1-4H3,(H,21,25)(H,23,24)