(4-methylsulfanylphenyl) 2,3-dihydro-1H-benzotriazole-5-carboxylate

Systemtic Name: (4-methylsulfanylphenyl) 2,3-dihydro-1H-benzotriazole-5-carboxylate Openeye Name: (4-methylsulfanylphenyl) 2,3-dihydro-1H-benzotriazole-5-carboxylate CAS Name: 2,3-dihydro-1H-benzotriazole-5-carboxylic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 2,3-dihydro-1H-benzotriazole-5-carboxylate Traditional Name: 2,3-dihydro-1H-benzotriazole-5-carboxylic acid [4-(methylthio)phenyl] ester Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)NNN3

Isomeric SMILES

CSC1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)NNN3

InChI

InChI=1S/C14H13N3O2S/c1-20-11-5-3-10(4-6-11)19-14(18)9-2-7-12-13(8-9)16-17-15-12/h2-8,15-17H,1H3