4-[6-[(2-methylphenyl)carbamoyl]-2-sulfanylidene-1H-pyrimidin-4-yl]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-[6-[(2-methylphenyl)carbamoyl]-2-sulfanylidene-1H-pyrimidin-4-yl]-N-oxidanyl-benzeneamine oxide Openeye Name: N-hydroxy-4-[6-(o-tolylcarbamoyl)-2-thioxo-1H-pyrimidin-4-yl]benzeneamine oxide CAS Name: N-hydroxy-4-[6-[(2-methylanilino)-oxomethyl]-2-sulfanylidene-1H-pyrimidin-4-yl]benzeneamine oxide IUPAC Name: N-hydroxy-4-[6-[(2-methylphenyl)carbamoyl]-2-sulfanylidene-1H-pyrimidin-4-yl]benzeneamine oxide Traditional Name: N-hydroxy-4-[6-(o-tolylcarbamoyl)-2-thioxo-1H-pyrimidin-4-yl]benzeneamine oxide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC(=NC(=S)N2)C3=CC=C(C=C3)[NH+](O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC(=NC(=S)N2)C3=CC=C(C=C3)[NH+](O)[O-]

InChI

InChI=1S/C18H16N4O3S/c1-11-4-2-3-5-14(11)19-17(23)16-10-15(20-18(26)21-16)12-6-8-13(9-7-12)22(24)25/h2-10,22,24H,1H3,(H,19,23)(H,20,21,26)