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

Systemtic Name: 6-ethyl-2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-methyl-pyrimidin-4-olate Openeye Name: 6-ethyl-2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanyl-5-methyl-pyrimidin-4-olate CAS Name: 6-ethyl-2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-5-methyl-4-pyrimidinolate IUPAC Name: 6-ethyl-2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-5-methylpyrimidin-4-olate Traditional Name: 6-ethyl-2-[[2-keto-2-(p-anisidino)ethyl]thio]-5-methyl-pyrimidin-4-olate Formula: C16H18N3O3S- MolecularWeight: 332.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)OC)[O-])C

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)OC)[O-])C

InChI

InChI=1S/C16H19N3O3S/c1-4-13-10(2)15(21)19-16(18-13)23-9-14(20)17-11-5-7-12(22-3)8-6-11/h5-8H,4,9H2,1-3H3,(H,17,20)(H,18,19,21)/p-1