[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [2-(4-chlorophenyl)thiazol-4-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [2-(4-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [2-(4-chlorophenyl)thiazol-4-yl]methyl ester Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O2S/c22-18-8-6-16(7-9-18)20-24-19(14-28-20)13-27-21(26)17-4-2-15(3-5-17)12-25-11-1-10-23-25/h1-11,14H,12-13H2