4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 4-[[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 4-[[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]methyl]-7-methyl-coumarin Formula: C25H19N3O5S MolecularWeight: 473.50046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(N3C5=CC=CC=C5OC)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(N3C5=CC=CC=C5OC)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O5S/c1-15-7-9-18-16(12-24(29)33-23(18)11-15)14-34-25-26-19-13-17(28(30)31)8-10-20(19)27(25)21-5-3-4-6-22(21)32-2/h3-13H,14H2,1-2H3