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

Systemtic Name: ethyl 2-[[cyclohexyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclohexyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(3,4-dimethylanilino)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclohexyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H29N3O3S/c1-4-28-21(26)19-14-29-20(24-19)13-25(18-8-6-5-7-9-18)22(27)23-17-11-10-15(2)16(3)12-17/h10-12,14,18H,4-9,13H2,1-3H3,(H,23,27)