1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]cyclohexane-1-carbonitrile

Systemtic Name: 1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]cyclohexanecarbonitrile CAS Name: 1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-butyl-4-[4-(5-butyl-1,3-dithian-2-yl)phenyl]cyclohexanecarbonitrile Formula: C25H37NS2 MolecularWeight: 415.69798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CSC(SC1)C2=CC=C(C=C2)C3CCC(CC3)(CCCC)C#N

Isomeric SMILES

CCCCC1CSC(SC1)C2=CC=C(C=C2)C3CCC(CC3)(CCCC)C#N

InChI

InChI=1S/C25H37NS2/c1-3-5-7-20-17-27-24(28-18-20)23-10-8-21(9-11-23)22-12-15-25(19-26,16-13-22)14-6-4-2/h8-11,20,22,24H,3-7,12-18H2,1-2H3