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

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

CCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C3CC3

InChI

InChI=1S/C20H24N2O3S/c1-3-4-5-14-6-8-15(9-7-14)19(23)22(16-10-11-16)12-18-21-17(13-26-18)20(24)25-2/h6-9,13,16H,3-5,10-12H2,1-2H3