N-[3-[(4-bromophenyl)carbonylamino]propyl]-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[3-[(4-bromophenyl)carbonylamino]propyl]-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[3-[(4-bromobenzoyl)amino]propyl]-2-[(2-isopropyl-5-methyl-phenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[3-[[(4-bromophenyl)-oxomethyl]amino]propyl]-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[3-[(4-bromobenzoyl)amino]propyl]-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[3-[(4-bromobenzoyl)amino]propyl]-2-[(2-isopropyl-5-methyl-phenoxy)methyl]thiazole-4-carboxamide Formula: C25H28BrN3O3S MolecularWeight: 530.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NC(=CS2)C(=O)NCCCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NC(=CS2)C(=O)NCCCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H28BrN3O3S/c1-16(2)20-10-5-17(3)13-22(20)32-14-23-29-21(15-33-23)25(31)28-12-4-11-27-24(30)18-6-8-19(26)9-7-18/h5-10,13,15-16H,4,11-12,14H2,1-3H3,(H,27,30)(H,28,31)