5-(1H-imidazol-2-ylsulfanyl)-2,3-dimethoxy-naphthalene-1,4-dione

Systemtic Name: 5-(1H-imidazol-2-ylsulfanyl)-2,3-dimethoxy-naphthalene-1,4-dione Openeye Name: 5-(1H-imidazol-2-ylsulfanyl)-2,3-dimethoxy-naphthalene-1,4-dione CAS Name: 5-(1H-imidazol-2-ylthio)-2,3-dimethoxynaphthalene-1,4-dione IUPAC Name: 5-(1H-imidazol-2-ylsulfanyl)-2,3-dimethoxynaphthalene-1,4-dione Traditional Name: 5-(1H-imidazol-2-ylthio)-2,3-dimethoxy-1,4-naphthoquinone Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C2=C(C1=O)C=CC=C2SC3=NC=CN3)OC

Isomeric SMILES

COC1=C(C(=O)C2=C(C1=O)C=CC=C2SC3=NC=CN3)OC

InChI

InChI=1S/C15H12N2O4S/c1-20-13-11(18)8-4-3-5-9(22-15-16-6-7-17-15)10(8)12(19)14(13)21-2/h3-7H,1-2H3,(H,16,17)