N-(cyanomethyl)-6-[2-(4-methylsulfanylphenyl)phenyl]spiro[2.5]octane-7-carboxamide

Systemtic Name: N-(cyanomethyl)-6-[2-(4-methylsulfanylphenyl)phenyl]spiro[2.5]octane-7-carboxamide Openeye Name: N-(cyanomethyl)-6-[2-(4-methylsulfanylphenyl)phenyl]spiro[2.5]octane-7-carboxamide CAS Name: N-(cyanomethyl)-6-[2-[4-(methylthio)phenyl]phenyl]-7-spiro[2.5]octanecarboxamide IUPAC Name: N-(cyanomethyl)-6-[2-(4-methylsulfanylphenyl)phenyl]spiro[2.5]octane-7-carboxamide Traditional Name: N-(cyanomethyl)-6-[2-[4-(methylthio)phenyl]phenyl]spiro[2.5]octane-7-carboxamide Formula: C24H26N2OS MolecularWeight: 390.54104

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC=CC=C2C3CCC4(CC4)CC3C(=O)NCC#N

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC=CC=C2C3CCC4(CC4)CC3C(=O)NCC#N

InChI

InChI=1S/C24H26N2OS/c1-28-18-8-6-17(7-9-18)19-4-2-3-5-20(19)21-10-11-24(12-13-24)16-22(21)23(27)26-15-14-25/h2-9,21-22H,10-13,15-16H2,1H3,(H,26,27)