2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-oxidanylidene-3-prop-2-enyl-pyrimidin-4-olate

Systemtic Name: 2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-oxidanylidene-3-prop-2-enyl-pyrimidin-4-olate Openeye Name: 3-allyl-2-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-5-ethyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-(tert-butylamino)-2-oxoethyl]thio]-5-ethyl-6-oxo-3-prop-2-enyl-4-pyrimidinolate IUPAC Name: 2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-5-ethyl-6-oxo-3-prop-2-enylpyrimidin-4-olate Traditional Name: 3-allyl-2-[[2-(tert-butylamino)-2-keto-ethyl]thio]-5-ethyl-6-keto-pyrimidin-4-olate Formula: C15H22N3O3S- MolecularWeight: 324.41848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=NC1=O)SCC(=O)NC(C)(C)C)CC=C)[O-]

Isomeric SMILES

CCC1=C(N(C(=NC1=O)SCC(=O)NC(C)(C)C)CC=C)[O-]

InChI

InChI=1S/C15H23N3O3S/c1-6-8-18-13(21)10(7-2)12(20)16-14(18)22-9-11(19)17-15(3,4)5/h6,21H,1,7-9H2,2-5H3,(H,17,19)/p-1