N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(2H-triazol-4-ylsulfanyl)acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2H-triazol-4-ylthio)acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2H-triazol-4-ylsulfanyl)acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(2H-triazol-4-ylthio)acetamide Formula: C13H13N5OS2 MolecularWeight: 319.40522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NNN=C3)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NNN=C3)C#N

InChI

InChI=1S/C13H13N5OS2/c14-5-9-8-3-1-2-4-10(8)21-13(9)16-11(19)7-20-12-6-15-18-17-12/h6H,1-4,7H2,(H,16,19)(H,15,17,18)