1-phenyl-3-(1,2,3,10-tetramethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl)thiourea

Systemtic Name: 1-phenyl-3-(1,2,3,10-tetramethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl)thiourea Openeye Name: 1-phenyl-3-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)thiourea CAS Name: 1-phenyl-3-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)thiourea IUPAC Name: 1-phenyl-3-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)thiourea Traditional Name: 1-(9-keto-1,2,3,10-tetramethoxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl)-3-phenyl-thiourea Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O5S/c1-31-22-13-11-18-19(15-21(22)30)20(29-27(35)28-17-8-6-5-7-9-17)12-10-16-14-23(32-2)25(33-3)26(34-4)24(16)18/h5-9,11,13-15,20H,10,12H2,1-4H3,(H2,28,29,35)