5-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]-3-(4-ethoxyphenyl)-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 5-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]-3-(4-ethoxyphenyl)-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]-3-(4-ethoxyphenyl)-2-thioxo-pyrimidin-4-olate CAS Name: 5-[(1Z)-1-(carbamothioylhydrazinylidene)ethyl]-3-(4-ethoxyphenyl)-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 5-[(Z)-N-(carbamothioylamino)-C-methylcarbonimidoyl]-3-(4-ethoxyphenyl)-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-[(Z)-C-methyl-N-thioureido-carbonimidoyl]-3-p-phenetyl-2-thioxo-pyrimidin-4-olate Formula: C15H16N5O2S2- MolecularWeight: 362.44984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=C(C=NC2=S)C(=NNC(=S)N)C)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=C(C=NC2=S)/C(=N\NC(=S)N)/C)[O-]

InChI

InChI=1S/C15H17N5O2S2/c1-3-22-11-6-4-10(5-7-11)20-13(21)12(8-17-15(20)24)9(2)18-19-14(16)23/h4-8,21H,3H2,1-2H3,(H3,16,19,23)/p-1/b18-9-