N-butyl-2-[[butyl(octanoyl)amino]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[[butyl(octanoyl)amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-butyl-2-[[butyl(octanoyl)amino]methyl]thiazole-4-carboxamide CAS Name: N-butyl-2-[[butyl(1-oxooctyl)amino]methyl]-4-thiazolecarboxamide IUPAC Name: N-butyl-2-[[butyl(octanoyl)amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-butyl-2-[[butyl(caprylyl)amino]methyl]thiazole-4-carboxamide Formula: C21H37N3O2S MolecularWeight: 395.60238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CCCC)CC1=NC(=CS1)C(=O)NCCCC

Isomeric SMILES

CCCCCCCC(=O)N(CCCC)CC1=NC(=CS1)C(=O)NCCCC

InChI

InChI=1S/C21H37N3O2S/c1-4-7-10-11-12-13-20(25)24(15-9-6-3)16-19-23-18(17-27-19)21(26)22-14-8-5-2/h17H,4-16H2,1-3H3,(H,22,26)