methyl 5-(2-chloroethyl)-4-phenyl-1,3-thiazole-2-carboxylate

Systemtic Name: methyl 5-(2-chloroethyl)-4-phenyl-1,3-thiazole-2-carboxylate Openeye Name: methyl 5-(2-chloroethyl)-4-phenyl-thiazole-2-carboxylate CAS Name: 5-(2-chloroethyl)-4-phenyl-2-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-chloroethyl)-4-phenyl-1,3-thiazole-2-carboxylate Traditional Name: 5-(2-chloroethyl)-4-phenyl-thiazole-2-carboxylic acid methyl ester Formula: C13H12ClNO2S MolecularWeight: 281.75788

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C(S1)CCCl)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NC(=C(S1)CCCl)C2=CC=CC=C2

InChI

InChI=1S/C13H12ClNO2S/c1-17-13(16)12-15-11(10(18-12)7-8-14)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3