N-[2-(4-methylphenyl)sulfanylethyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[2-(p-tolylthio)ethyl]-2H-benzotriazole-5-carboxamide Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C16H16N4OS/c1-11-2-5-13(6-3-11)22-9-8-17-16(21)12-4-7-14-15(10-12)19-20-18-14/h2-7,10H,8-9H2,1H3,(H,17,21)(H,18,19,20)