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4-Amino-6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
SpectraBase Compound ID GSIUttE75fS
InChI InChI=1S/C12H10N4S/c1-7-2-4-8(5-3-7)10-9(6-13)11(14)16-12(17)15-10/h2-5H,1H3,(H3,14,15,16,17)
InChIKey VHFGQVKCHHHGJG-UHFFFAOYSA-N
Mol Weight 242.3 g/mol
Molecular Formula C12H10N4S
Exact Mass 242.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wSPCPm9Dof
Name 4-Amino-6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
Alternate Name(s) 4-Amino-6-(p-tolyl)-2-thioxo-1H-pyrimidine-5-carbonitrile 4-Azanyl-6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Pyrimidine-5-carbonitrile, 4-amino-2-mercapto-6-p-tolyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4S
InChI InChI=1S/C12H10N4S/c1-7-2-4-8(5-3-7)10-9(6-13)11(14)16-12(17)15-10/h2-5H,1H3,(H3,14,15,16,17)
InChIKey VHFGQVKCHHHGJG-UHFFFAOYSA-N
Molecular Weight 242.300 g/mol
SMILES Nc1nc(nc(c1C#N)-c1ccc(cc1)C)S
SPLASH splash10-0006-5590000000-03e27be0c8e5f659d3c2
Wiley ID 1436687