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

Systemtic Name: 2-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]sulfanyl-5-ethyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]thio]-5-ethyl-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]sulfanyl-5-ethyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]thio]-5-ethyl-6-methyl-pyrimidin-4-olate Formula: C16H17ClN3O3S- MolecularWeight: 366.84248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=C(C=CC(=C2)Cl)OC)C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=C(C=CC(=C2)Cl)OC)C

InChI

InChI=1S/C16H18ClN3O3S/c1-4-11-9(2)18-16(20-15(11)22)24-8-14(21)19-12-7-10(17)5-6-13(12)23-3/h5-7H,4,8H2,1-3H3,(H,19,21)(H,18,20,22)/p-1