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

Systemtic Name: 2-[[(2-methylphenyl)carbonyl-(2-methylpropyl)amino]methyl]-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide Openeye Name: N-isobutyl-2-[[isobutyl-(2-methylbenzoyl)amino]methyl]thiazole-4-carboxamide CAS Name: 2-[[[(2-methylphenyl)-oxomethyl]-(2-methylpropyl)amino]methyl]-N-(2-methylpropyl)-4-thiazolecarboxamide IUPAC Name: 2-[[(2-methylbenzoyl)-(2-methylpropyl)amino]methyl]-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide Traditional Name: N-isobutyl-2-[[isobutyl(o-toluoyl)amino]methyl]thiazole-4-carboxamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CC2=NC(=CS2)C(=O)NCC(C)C)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CC2=NC(=CS2)C(=O)NCC(C)C)CC(C)C

InChI

InChI=1S/C21H29N3O2S/c1-14(2)10-22-20(25)18-13-27-19(23-18)12-24(11-15(3)4)21(26)17-9-7-6-8-16(17)5/h6-9,13-15H,10-12H2,1-5H3,(H,22,25)