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2,5-bis(2'-Benzothiazolyl)-4-(p-tolylamino)-3-(4"-tolylimino)-3H-pyrrole
SpectraBase Compound ID WngrIbn8SU
InChI InChI=1S/C32H23N5S2/c1-19-11-15-21(16-12-19)33-27-28(34-22-17-13-20(2)14-18-22)30(32-36-24-8-4-6-10-26(24)39-32)37-29(27)31-35-23-7-3-5-9-25(23)38-31/h3-18H,1-2H3,(H,33,34)
InChIKey JVYMEYCAJQEAIO-UHFFFAOYSA-N
Mol Weight 541.7 g/mol
Molecular Formula C32H23N5S2
Exact Mass 541.139488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZ1YKHd4naV
Name 2,5-bis(2'-Benzothiazolyl)-4-(p-tolylamino)-3-(4"-tolylimino)-3H-pyrrole
Alternate Name(s) 2,5-bis(1,3-benzothiazol-2-yl)-N-(4-methylphenyl)-4-(4-methylphenyl)imino-3-pyrrolamine 2,5-bis(1,3-benzothiazol-2-yl)-N-(4-methylphenyl)-4-(4-methylphenyl)iminopyrrol-3-amine 2,5-bis(1,3-benzothiazol-2-yl)-N-(p-tolyl)-4-(p-tolylimino)pyrrol-3-amine 2,5-bis(1,3-benzothiazol-2-yl)-N-(4-methylphenyl)-4-(4-methylphenyl)imino-pyrrol-3-amine
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Formula C32H23N5S2
InChI InChI=1S/C32H23N5S2/c1-19-11-15-21(16-12-19)33-27-28(34-22-17-13-20(2)14-18-22)30(32-36-24-8-4-6-10-26(24)39-32)37-29(27)31-35-23-7-3-5-9-25(23)38-31/h3-18H,1-2H3,(H,33,34)
InChIKey JVYMEYCAJQEAIO-UHFFFAOYSA-N
Molecular Weight 541.691 g/mol
SMILES N(C1=C(N=C(c2nc3ccccc3s2)\C1=N\c1ccc(cc1)C)c1nc2ccccc2s1)c1ccc(cc1)C
SPLASH splash10-0f6x-0440690000-b883ad70981e14ab4036
Source of Spectrum U1-2009-3411-6a
Wiley ID 1696952