N-hexyl-2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-hexyl-2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-hexyl-2-[[isopropyl(phenylcarbamoyl)amino]methyl]thiazole-4-carboxamide CAS Name: 2-[[[anilino(oxo)methyl]-propan-2-ylamino]methyl]-N-hexyl-4-thiazolecarboxamide IUPAC Name: N-hexyl-2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-hexyl-2-[[isopropyl(phenylcarbamoyl)amino]methyl]thiazole-4-carboxamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCNC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H30N4O2S/c1-4-5-6-10-13-22-20(26)18-15-28-19(24-18)14-25(16(2)3)21(27)23-17-11-8-7-9-12-17/h7-9,11-12,15-16H,4-6,10,13-14H2,1-3H3,(H,22,26)(H,23,27)