(3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenyl-chromen-4-one

Systemtic Name: (3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenyl-chromen-4-one Openeye Name: (3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenyl-chroman-4-one CAS Name: (3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenylchromen-4-one Traditional Name: (3Z)-3-(5-tert-butyl-1,3-benzodithiol-2-ylidene)-2-phenyl-chroman-4-one Formula: C26H22O2S2 MolecularWeight: 430.58168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)SC(=C3C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5)S2

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)S/C(=C/3\C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5)/S2

InChI

InChI=1S/C26H22O2S2/c1-26(2,3)17-13-14-20-21(15-17)30-25(29-20)22-23(27)18-11-7-8-12-19(18)28-24(22)16-9-5-4-6-10-16/h4-15,24H,1-3H3/b25-22+