ethyl 5-[(4-chlorophenyl)amino]-1-(propan-2-ylcarbamoyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-chlorophenyl)amino]-1-(propan-2-ylcarbamoyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4-chloroanilino)-1-(isopropylcarbamoyl)triazole-4-carboxylate CAS Name: 5-(4-chloroanilino)-1-[oxo-(propan-2-ylamino)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chloroanilino)-1-(propan-2-ylcarbamoyl)triazole-4-carboxylate Traditional Name: 5-(4-chloroanilino)-1-(isopropylcarbamoyl)triazole-4-carboxylic acid ethyl ester Formula: C15H18ClN5O3 MolecularWeight: 351.78812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C(=O)NC(C)C)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C(=O)NC(C)C)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN5O3/c1-4-24-14(22)12-13(18-11-7-5-10(16)6-8-11)21(20-19-12)15(23)17-9(2)3/h5-9,18H,4H2,1-3H3,(H,17,23)