methyl 2-[[cyclohexyl-[(4-methylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[cyclohexyl-[(4-methylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[cyclohexyl(p-tolylcarbamoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(4-methylanilino)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclohexyl-[(4-methylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl(p-tolylcarbamoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(CC2=NC(=CS2)C(=O)OC)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(CC2=NC(=CS2)C(=O)OC)C3CCCCC3

InChI

InChI=1S/C20H25N3O3S/c1-14-8-10-15(11-9-14)21-20(25)23(16-6-4-3-5-7-16)12-18-22-17(13-27-18)19(24)26-2/h8-11,13,16H,3-7,12H2,1-2H3,(H,21,25)