methyl 2-[[(4-tert-butylphenyl)carbonyl-cyclopropyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-tert-butylphenyl)carbonyl-cyclopropyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-tert-butylbenzoyl)-cyclopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-tert-butylphenyl)-oxomethyl]-cyclopropylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-tert-butylbenzoyl)-cyclopropylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-tert-butylbenzoyl)-cyclopropyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C3CC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C3CC3

InChI

InChI=1S/C20H24N2O3S/c1-20(2,3)14-7-5-13(6-8-14)18(23)22(15-9-10-15)11-17-21-16(12-26-17)19(24)25-4/h5-8,12,15H,9-11H2,1-4H3