2-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-[[2-(2-ethylanilino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[2-[[2-(2-ethylanilino)-2-keto-ethyl]-methyl-amino]-2-keto-ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C20H25N4O3S- MolecularWeight: 401.5025

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2CC)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2CC)[O-]

InChI

InChI=1S/C20H26N4O3S/c1-4-8-15-11-17(25)23-20(21-15)28-13-19(27)24(3)12-18(26)22-16-10-7-6-9-14(16)5-2/h6-7,9-11H,4-5,8,12-13H2,1-3H3,(H,22,26)(H,21,23,25)/p-1