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

Systemtic Name: 2-(benzotriazol-1-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: 2-(benzotriazol-1-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-(1-benzotriazolylthio)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-(benzotriazol-1-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-(benzotriazol-1-ylthio)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C17H15N5OS2 MolecularWeight: 369.4639

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CSN3C4=CC=CC=C4N=N3)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CSN3C4=CC=CC=C4N=N3)C#N

InChI

InChI=1S/C17H15N5OS2/c18-9-12-11-5-1-4-8-15(11)25-17(12)19-16(23)10-24-22-14-7-3-2-6-13(14)20-21-22/h2-3,6-7H,1,4-5,8,10H2,(H,19,23)