4-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one

Systemtic Name: 4-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Openeye Name: 4-[(1-isobutylbenzimidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one CAS Name: 4-[[[1-(2-methylpropyl)-2-benzimidazolyl]thio]methyl]-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-2-one IUPAC Name: 4-[[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Traditional Name: 4-[[(1-isobutylbenzimidazol-2-yl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

InChI

InChI=1S/C24H24N2O2S/c1-15(2)13-26-21-9-4-3-8-20(21)25-24(26)29-14-18-12-23(27)28-22-11-17-7-5-6-16(17)10-19(18)22/h3-4,8-12,15H,5-7,13-14H2,1-2H3