2-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-[benzyl(ethyl)amino]-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-[ethyl-(phenylmethyl)amino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-[benzyl(ethyl)amino]-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-[benzyl(ethyl)amino]-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C15H16N3O2S- MolecularWeight: 302.37144

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC=CC(=N2)[O-]

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC=CC(=N2)[O-]

InChI

InChI=1S/C15H17N3O2S/c1-2-18(10-12-6-4-3-5-7-12)14(20)11-21-15-16-9-8-13(19)17-15/h3-9H,2,10-11H2,1H3,(H,16,17,19)/p-1