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

Systemtic Name: 1-butyl-4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-butyl-4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]cyclohexanecarbonitrile CAS Name: 1-butyl-4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-butyl-4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-butyl-4-[4-(5-ethyl-1,3-dithian-2-yl)phenyl]cyclohexanecarbonitrile Formula: C23H33NS2 MolecularWeight: 387.64482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCC(CC1)C2=CC=C(C=C2)C3SCC(CS3)CC)C#N

Isomeric SMILES

CCCCC1(CCC(CC1)C2=CC=C(C=C2)C3SCC(CS3)CC)C#N

InChI

InChI=1S/C23H33NS2/c1-3-5-12-23(17-24)13-10-20(11-14-23)19-6-8-21(9-7-19)22-25-15-18(4-2)16-26-22/h6-9,18,20,22H,3-5,10-16H2,1-2H3