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

Systemtic Name: 2-[[(4-pentylphenyl)carbonyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: N-isopropyl-2-[[isopropyl-(4-pentylbenzoyl)amino]methyl]thiazole-4-carboxamide CAS Name: 2-[[[oxo-(4-pentylphenyl)methyl]-propan-2-ylamino]methyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-pentylbenzoyl)-propan-2-ylamino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-amylbenzoyl)-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide Formula: C23H33N3O2S MolecularWeight: 415.59202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)NC(C)C)C(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)NC(C)C)C(C)C

InChI

InChI=1S/C23H33N3O2S/c1-6-7-8-9-18-10-12-19(13-11-18)23(28)26(17(4)5)14-21-25-20(15-29-21)22(27)24-16(2)3/h10-13,15-17H,6-9,14H2,1-5H3,(H,24,27)