N-(2-methylphenyl)-4-[4-[oxidanidyl(oxidanyl)amino]phenyl]-2-sulfanylidene-1H-pyrimidine-6-carboxamide

Systemtic Name: N-(2-methylphenyl)-4-[4-[oxidanidyl(oxidanyl)amino]phenyl]-2-sulfanylidene-1H-pyrimidine-6-carboxamide Openeye Name: 4-[4-[hydroxy(oxido)amino]phenyl]-N-(o-tolyl)-2-thioxo-1H-pyrimidine-6-carboxamide CAS Name: 4-[4-[hydroxy(oxido)amino]phenyl]-N-(2-methylphenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxamide IUPAC Name: 4-[4-[hydroxy(oxido)amino]phenyl]-N-(2-methylphenyl)-2-sulfanylidene-1H-pyrimidine-6-carboxamide Traditional Name: 4-[4-[hydroxy(oxido)amino]phenyl]-N-(o-tolyl)-2-thioxo-1H-pyrimidine-6-carboxamide Formula: C18H15N4O3S- MolecularWeight: 367.4017

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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)N(O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H15N4O3S/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/h2-10,24H,1H3,(H,19,23)(H,20,21,26)/q-1