(E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenyl-pent-4-ene-1,3-dione

Systemtic Name: (E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenyl-pent-4-ene-1,3-dione Openeye Name: (E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenyl-pent-4-ene-1,3-dione CAS Name: (E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenyl-4-pentene-1,3-dione IUPAC Name: (E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenylpent-4-ene-1,3-dione Traditional Name: (E)-2-(1,3-dithiepan-2-ylidene)-5-(2-methoxyphenyl)-1-phenyl-pent-4-ene-1,3-dione Formula: C23H22O3S2 MolecularWeight: 410.54898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)C(=C2SCCCCS2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1/C=C/C(=O)C(=C2SCCCCS2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22O3S2/c1-26-20-12-6-5-9-17(20)13-14-19(24)21(23-27-15-7-8-16-28-23)22(25)18-10-3-2-4-11-18/h2-6,9-14H,7-8,15-16H2,1H3/b14-13+