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

Systemtic Name: 2-[[(4-hexylphenyl)carbonyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-hexylbenzoyl)-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide CAS Name: 2-[[[(4-hexylphenyl)-oxomethyl]-propan-2-ylamino]methyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-hexylbenzoyl)-propan-2-ylamino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-hexylbenzoyl)-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide Formula: C24H35N3O2S MolecularWeight: 429.6186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)NC(C)C)C(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)NC(C)C)C(C)C

InChI

InChI=1S/C24H35N3O2S/c1-6-7-8-9-10-19-11-13-20(14-12-19)24(29)27(18(4)5)15-22-26-21(16-30-22)23(28)25-17(2)3/h11-14,16-18H,6-10,15H2,1-5H3,(H,25,28)