2-propylsulfanylethyl 2,3-dihydro-1H-benzotriazole-5-carboxylate

Systemtic Name: 2-propylsulfanylethyl 2,3-dihydro-1H-benzotriazole-5-carboxylate Openeye Name: 2-propylsulfanylethyl 2,3-dihydro-1H-benzotriazole-5-carboxylate CAS Name: 2,3-dihydro-1H-benzotriazole-5-carboxylic acid 2-(propylthio)ethyl ester IUPAC Name: 2-propylsulfanylethyl 2,3-dihydro-1H-benzotriazole-5-carboxylate Traditional Name: 2,3-dihydro-1H-benzotriazole-5-carboxylic acid 2-(propylthio)ethyl ester Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCOC(=O)C1=CC2=C(C=C1)NNN2

Isomeric SMILES

CCCSCCOC(=O)C1=CC2=C(C=C1)NNN2

InChI

InChI=1S/C12H17N3O2S/c1-2-6-18-7-5-17-12(16)9-3-4-10-11(8-9)14-15-13-10/h3-4,8,13-15H,2,5-7H2,1H3