2-[[propan-2-yl-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[[propan-2-yl-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[[isopropyl-[(4-isopropylphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid CAS Name: 2-[[[oxo-(4-propan-2-ylanilino)methyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[[propan-2-yl-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[[isopropyl(p-cumenylcarbamoyl)amino]methyl]thiazole-4-carboxylic acid Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3S/c1-11(2)13-5-7-14(8-6-13)19-18(24)21(12(3)4)9-16-20-15(10-25-16)17(22)23/h5-8,10-12H,9H2,1-4H3,(H,19,24)(H,22,23)