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

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[2-(p-tolylmethylsulfanyl)ethyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[2-[(4-methylbenzyl)thio]ethyl]-2H-benzotriazole-5-carboxamide Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4OS/c1-12-2-4-13(5-3-12)11-23-9-8-18-17(22)14-6-7-15-16(10-14)20-21-19-15/h2-7,10H,8-9,11H2,1H3,(H,18,22)(H,19,20,21)