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2-Methyl-3-(p-bromophenyl)-6,7-dihydro-5H-2a-thia(2a-S(IV))-2,3,4a,7a-tetraazacyclopent[cd]indene-1,4(2H,3H)-dithione
SpectraBase Compound ID JrY1DC4Ha4W
InChI InChI=1S/C13H13BrN4S3/c1-15-11(19)16-7-2-8-17-12(20)18(21(15)13(16)17)10-5-3-9(14)4-6-10/h3-6H,2,7-8H2,1H3
InChIKey IVRZFIROXMGKNS-UHFFFAOYSA-N
Mol Weight 401.36 g/mol
Molecular Formula C13H13BrN4S3
Exact Mass 399.948573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5g2BZ7I9NJS
Name 2-Methyl-3-(p-bromophenyl)-6,7-dihydro-5H-2a-thia(2a-S(IV))-2,3,4a,7a-tetraazacyclopent[cd]indene-1,4(2H,3H)-dithione
Alternate Name(s) 2-(4-bromophenyl)-3-methyl-6,7-dihydro-5H-2alambda(4)-thia-2,3,4a,7a-tetraazacyclopenta[cd]indene-1,4(2H,3H)-dithione 2-Methyl-3-(4'-bromophenyl)-6,7-dihydro-5H-2a-thia[2a-S(IV)]-2,3,4a,7a-tetraazacyclopenta[cd]indene-1,4(2H,3H)-dithione
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Formula C13H13BrN4S3
InChI InChI=1S/C13H13BrN4S3/c1-15-11(19)16-7-2-8-17-12(20)18(21(15)13(16)17)10-5-3-9(14)4-6-10/h3-6H,2,7-8H2,1H3
InChIKey IVRZFIROXMGKNS-UHFFFAOYSA-N
Molecular Weight 401.359 g/mol
SMILES C12=S3N(C(N1CCCN2C(N3c1ccc(cc1)Br)=S)=S)C
SPLASH splash10-02t9-4590000000-ae1c628d4b46254948d3
Source of Spectrum Y-28-223-4
Wiley ID 1369181