2-[2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(m-anisylamino)ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C15H16N3O3S- MolecularWeight: 318.37084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC(=CC=C2)OC)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NCC2=CC(=CC=C2)OC)[O-]

InChI

InChI=1S/C15H17N3O3S/c1-10-6-13(19)18-15(17-10)22-9-14(20)16-8-11-4-3-5-12(7-11)21-2/h3-7H,8-9H2,1-2H3,(H,16,20)(H,17,18,19)/p-1