4,6-di(butan-2-yl)-5-(phenylmethyl)cyclohexa-2,4-diene-1-thione

Systemtic Name: 4,6-di(butan-2-yl)-5-(phenylmethyl)cyclohexa-2,4-diene-1-thione Openeye Name: 5-benzyl-4,6-disec-butyl-cyclohexa-2,4-diene-1-thione CAS Name: 4,6-di(butan-2-yl)-5-(phenylmethyl)-1-cyclohexa-2,4-dienethione IUPAC Name: 5-benzyl-4,6-di(butan-2-yl)cyclohexa-2,4-diene-1-thione Traditional Name: 5-benzyl-4,6-disec-butyl-cyclohexa-2,4-diene-1-thione Formula: C21H28S MolecularWeight: 312.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=S)C=CC(=C1CC2=CC=CC=C2)C(C)CC

Isomeric SMILES

CCC(C)C1C(=S)C=CC(=C1CC2=CC=CC=C2)C(C)CC

InChI

InChI=1S/C21H28S/c1-5-15(3)18-12-13-20(22)21(16(4)6-2)19(18)14-17-10-8-7-9-11-17/h7-13,15-16,21H,5-6,14H2,1-4H3