Vitas-M small molecule compound
6-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)-N'-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine
Catalog ID
STK032098
SMILES Cc1ccc(cc1)Nc1nc(nc(n1)Nc1cccc(c1)[N+](=O)[O-])Sc1nc2c(s1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H17N7O2S2 MW 487.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N7O2S2/c1-14-9-11-15(12-10-14)24-20-27-21(25-16-5-4-6-17(13-16)30(31)32)29-22(28-20)34-23-26-18-7-2-3-8-19(18)33-23/h2-13H,1H3,(H2,24,25,27,28,29)InChIKey
ISEOQOCCRXCLNC-UHFFFAOYSA-NSynonyms
(6BENZOTHIAZOL2YLTHIO4((4METHYLPHENYL)AMINO)(135TRIAZIN2YL))(3NITROPHENYL)AMINE
6(13BENZOTHIAZOL2YLSULFANYL)4N(4METHYLPHENYL)2N(3NITROPHENYL)135TRIAZINE24DIAMINE
6(13BENZOTHIAZOL2YLSULFANYL)N(4METHYLPHENYL)N(3NITROPHENYL)135TRIAZINE24DIAMINE
CC1=CC=C(C=C1)NC2=NC(=NC(=N2)SC3=NC4=CC=CC=C4S3)NC5=CC(=CC=C5)(N+)(=O)(O)
Cc1ccc(cc1)Nc1nc(nc(n1)Nc1cccc(c1)(N+)(=O)(O))Sc1nc2c(s1)cccc2
InChI=1SC23H17N7O2S2c11491115(121014)24202721(251654617(1316)30(31)32)2922(2820)34232618723819(18)3323h213H1H3(H22425272829)
MFCD01951073
STK032098
ZINC000009113806
ZINC09113806
ZINC9113806
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