9-(1H-imidazol-2-ylsulfanylmethyl)-6,6-dimethyl-10a-(2-methyloctan-2-yl)-7,10-dihydro-6aH-benzo[c]chromen-1-ol

Systemtic Name: 9-(1H-imidazol-2-ylsulfanylmethyl)-6,6-dimethyl-10a-(2-methyloctan-2-yl)-7,10-dihydro-6aH-benzo[c]chromen-1-ol Openeye Name: 10a-(1,1-dimethylheptyl)-9-(1H-imidazol-2-ylsulfanylmethyl)-6,6-dimethyl-7,10-dihydro-6aH-benzo[c]chromen-1-ol CAS Name: 9-[(1H-imidazol-2-ylthio)methyl]-6,6-dimethyl-10a-(2-methyloctan-2-yl)-7,10-dihydro-6aH-benzo[c][1]benzopyran-1-ol IUPAC Name: 9-(1H-imidazol-2-ylsulfanylmethyl)-6,6-dimethyl-10a-(2-methyloctan-2-yl)-7,10-dihydro-6aH-benzo[c]chromen-1-ol Traditional Name: 10a-(1,1-dimethylheptyl)-9-[(1H-imidazol-2-ylthio)methyl]-6,6-dimethyl-7,10-dihydro-6aH-benzo[c]chromen-1-ol Formula: C28H40N2O2S MolecularWeight: 468.6944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C12CC(=CCC1C(OC3=C2C(=CC=C3)O)(C)C)CSC4=NC=CN4

Isomeric SMILES

CCCCCCC(C)(C)C12CC(=CCC1C(OC3=C2C(=CC=C3)O)(C)C)CSC4=NC=CN4

InChI

InChI=1S/C28H40N2O2S/c1-6-7-8-9-15-26(2,3)28-18-20(19-33-25-29-16-17-30-25)13-14-23(28)27(4,5)32-22-12-10-11-21(31)24(22)28/h10-13,16-17,23,31H,6-9,14-15,18-19H2,1-5H3,(H,29,30)