N-(cyanomethyl)-2-[2-(4-ethylsulfanylphenyl)phenyl]cyclohexane-1-carboxamide

Systemtic Name: N-(cyanomethyl)-2-[2-(4-ethylsulfanylphenyl)phenyl]cyclohexane-1-carboxamide Openeye Name: N-(cyanomethyl)-2-[2-(4-ethylsulfanylphenyl)phenyl]cyclohexanecarboxamide CAS Name: N-(cyanomethyl)-2-[2-[4-(ethylthio)phenyl]phenyl]-1-cyclohexanecarboxamide IUPAC Name: N-(cyanomethyl)-2-[2-(4-ethylsulfanylphenyl)phenyl]cyclohexane-1-carboxamide Traditional Name: N-(cyanomethyl)-2-[2-[4-(ethylthio)phenyl]phenyl]cyclohexanecarboxamide Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C2=CC=CC=C2C3CCCCC3C(=O)NCC#N

Isomeric SMILES

CCSC1=CC=C(C=C1)C2=CC=CC=C2C3CCCCC3C(=O)NCC#N

InChI

InChI=1S/C23H26N2OS/c1-2-27-18-13-11-17(12-14-18)19-7-3-4-8-20(19)21-9-5-6-10-22(21)23(26)25-16-15-24/h3-4,7-8,11-14,21-22H,2,5-6,9-10,16H2,1H3,(H,25,26)