4-(4-ethoxycarbonyl-1-sulfanylidene-pyrimido[1,6-a]benzimidazol-2-yl)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-(4-ethoxycarbonyl-1-sulfanylidene-pyrimido[1,6-a]benzimidazol-2-yl)-N-oxidanyl-benzeneamine oxide Openeye Name: 4-(4-ethoxycarbonyl-1-thioxo-pyrimido[1,6-a]benzimidazol-2-yl)-N-hydroxy-benzeneamine oxide CAS Name: 4-(4-ethoxycarbonyl-1-sulfanylidene-2-pyrimido[1,6-a]benzimidazolyl)-N-hydroxybenzeneamine oxide IUPAC Name: 4-(4-ethoxycarbonyl-1-sulfanylidenepyrimido[1,6-a]benzimidazol-2-yl)-N-hydroxybenzeneamine oxide Traditional Name: 4-(4-carbethoxy-1-thioxo-pyrimido[1,6-a]benzimidazol-2-yl)-N-hydroxy-benzeneamine oxide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=S)N2C1=NC3=CC=CC=C32)C4=CC=C(C=C4)[NH+](O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN(C(=S)N2C1=NC3=CC=CC=C32)C4=CC=C(C=C4)[NH+](O)[O-]

InChI

InChI=1S/C19H16N4O4S/c1-2-27-18(24)14-11-21(12-7-9-13(10-8-12)23(25)26)19(28)22-16-6-4-3-5-15(16)20-17(14)22/h3-11,23,25H,2H2,1H3