1-ethyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[2-(3-thienylmethylsulfanyl)ethyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[2-(3-thiophenylmethylthio)ethyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[2-(3-thenylthio)ethyl]benzotriazole-5-carboxamide Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCCSCC3=CSC=C3)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCCSCC3=CSC=C3)N=N1

InChI

InChI=1S/C16H18N4OS2/c1-2-20-15-4-3-13(9-14(15)18-19-20)16(21)17-6-8-23-11-12-5-7-22-10-12/h3-5,7,9-10H,2,6,8,11H2,1H3,(H,17,21)