ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methyl-isoxazole-3-carboxylate CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-5-methyl-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole-3-carboxylate Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-5-methyl-isoxazole-3-carboxylic acid ethyl ester Formula: C15H14N2O3S2 MolecularWeight: 334.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1CSC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCOC(=O)C1=NOC(=C1CSC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C15H14N2O3S2/c1-3-19-14(18)13-10(9(2)20-17-13)8-21-15-16-11-6-4-5-7-12(11)22-15/h4-7H,3,8H2,1-2H3