(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxylate CAS Name: 1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxylic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxylate Traditional Name: 1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxylic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C16H10ClN5O2S2 MolecularWeight: 403.8659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)OCC3=C(SN=N3)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)OCC3=C(SN=N3)Cl)C4=CC=CS4

InChI

InChI=1S/C16H10ClN5O2S2/c17-13-11(19-21-26-13)9-24-16(23)14-18-15(12-7-4-8-25-12)22(20-14)10-5-2-1-3-6-10/h1-8H,9H2