3,5-di(butan-2-yl)-4-(phenylmethyl)-6-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: 3,5-di(butan-2-yl)-4-(phenylmethyl)-6-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-one Openeye Name: 4-benzyl-3,5-disec-butyl-6-(6-thioxocyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-one CAS Name: 3,5-di(butan-2-yl)-4-(phenylmethyl)-6-(6-sulfanylidene-1-cyclohexa-1,3-dienyl)-1-cyclohexa-2,4-dienone IUPAC Name: 4-benzyl-3,5-di(butan-2-yl)-6-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-one Traditional Name: 4-benzyl-3,5-disec-butyl-6-(6-thioxocyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-one Formula: C27H32OS MolecularWeight: 404.60738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=O)C(C(=C1CC2=CC=CC=C2)C(C)CC)C3=CC=CCC3=S

Isomeric SMILES

CCC(C)C1=CC(=O)C(C(=C1CC2=CC=CC=C2)C(C)CC)C3=CC=CCC3=S

InChI

InChI=1S/C27H32OS/c1-5-18(3)22-17-24(28)27(21-14-10-11-15-25(21)29)26(19(4)6-2)23(22)16-20-12-8-7-9-13-20/h7-14,17-19,27H,5-6,15-16H2,1-4H3