1-tert-butyl-6-butylsulfanyl-6-(cyclopenta-1,4-dien-1-ylmethyl)-3-methyl-cyclohexa-1,3-diene

Systemtic Name: 1-tert-butyl-6-butylsulfanyl-6-(cyclopenta-1,4-dien-1-ylmethyl)-3-methyl-cyclohexa-1,3-diene Openeye Name: 1-tert-butyl-6-butylsulfanyl-6-(cyclopenta-1,4-dien-1-ylmethyl)-3-methyl-cyclohexa-1,3-diene CAS Name: 1-tert-butyl-6-(butylthio)-6-(1-cyclopenta-1,4-dienylmethyl)-3-methylcyclohexa-1,3-diene IUPAC Name: 1-tert-butyl-6-butylsulfanyl-6-(cyclopenta-1,4-dien-1-ylmethyl)-3-methylcyclohexa-1,3-diene Traditional Name: 1-tert-butyl-6-(butylthio)-6-(cyclopenta-1,4-dien-1-ylmethyl)-3-methyl-cyclohexa-1,3-diene Formula: C21H32S MolecularWeight: 316.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(CC=C(C=C1C(C)(C)C)C)CC2=CCC=C2

Isomeric SMILES

CCCCSC1(CC=C(C=C1C(C)(C)C)C)CC2=CCC=C2

InChI

InChI=1S/C21H32S/c1-6-7-14-22-21(16-18-10-8-9-11-18)13-12-17(2)15-19(21)20(3,4)5/h8,10-12,15H,6-7,9,13-14,16H2,1-5H3