2-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]thio]-6-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl-6-phenylpyrimidin-4-olate Traditional Name: 2-[[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]thio]-6-phenyl-pyrimidin-4-olate Formula: C19H15ClN3O3S- MolecularWeight: 400.8587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H16ClN3O3S/c1-26-16-8-7-13(20)9-15(16)21-18(25)11-27-19-22-14(10-17(24)23-19)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,21,25)(H,22,23,24)/p-1