2-(2,4,5-trimethyl-3-pyridin-2-yl-heptan-3-yl)cyclohexa-2,4-diene-1-thione

Systemtic Name: 2-(2,4,5-trimethyl-3-pyridin-2-yl-heptan-3-yl)cyclohexa-2,4-diene-1-thione Openeye Name: 2-[1-isopropyl-2,3-dimethyl-1-(2-pyridyl)pentyl]cyclohexa-2,4-diene-1-thione CAS Name: 2-[2,4,5-trimethyl-3-(2-pyridinyl)heptan-3-yl]-1-cyclohexa-2,4-dienethione IUPAC Name: 2-(2,4,5-trimethyl-3-pyridin-2-ylheptan-3-yl)cyclohexa-2,4-diene-1-thione Traditional Name: 2-[1-isopropyl-2,3-dimethyl-1-(2-pyridyl)pentyl]cyclohexa-2,4-diene-1-thione Formula: C21H29NS MolecularWeight: 327.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)C(C1=CC=CCC1=S)(C2=CC=CC=N2)C(C)C

Isomeric SMILES

CCC(C)C(C)C(C1=CC=CCC1=S)(C2=CC=CC=N2)C(C)C

InChI

InChI=1S/C21H29NS/c1-6-16(4)17(5)21(15(2)3,20-13-9-10-14-22-20)18-11-7-8-12-19(18)23/h7-11,13-17H,6,12H2,1-5H3