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

Systemtic Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Openeye Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one CAS Name: 4-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-2-one IUPAC Name: 4-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Traditional Name: 4-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

InChI

InChI=1S/C21H18N2O3S/c1-25-15-5-6-17-18(10-15)23-21(22-17)27-11-14-9-20(24)26-19-8-13-4-2-3-12(13)7-16(14)19/h5-10H,2-4,11H2,1H3,(H,22,23)