2-oxidanylidene-N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]chromene-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]chromene-3-carboxamide Openeye Name: 2-oxo-N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]chromene-3-carboxamide CAS Name: 2-oxo-N-[(7S)-1,2,3-trimethoxy-10-(methylthio)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]-1-benzopyran-3-carboxamide IUPAC Name: 2-oxo-N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]chromene-3-carboxamide Traditional Name: 2-keto-N-[(7S)-9-keto-1,2,3-trimethoxy-10-(methylthio)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]chromene-3-carboxamide Formula: C30H27NO7S MolecularWeight: 545.60288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)SC)NC(=O)C4=CC5=CC=CC=C5OC4=O)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)CC[C@@H](C3=CC(=O)C(=CC=C32)SC)NC(=O)C4=CC5=CC=CC=C5OC4=O)OC)OC

InChI

InChI=1S/C30H27NO7S/c1-35-24-14-17-9-11-21(31-29(33)20-13-16-7-5-6-8-23(16)38-30(20)34)19-15-22(32)25(39-4)12-10-18(19)26(17)28(37-3)27(24)36-2/h5-8,10,12-15,21H,9,11H2,1-4H3,(H,31,33)/t21-/m0/s1