Vitas-M small molecule compound

N-(4-methylphenyl)-6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine

Catalog ID
STK002742
SMILES Cc1ccc(cc1)Nc1nc(CSc2nncn2C)nc(n1)N

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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 C14H16N8S MW 328.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N8S/c1-9-3-5-10(6-4-9)17-13-19-11(18-12(15)20-13)7-23-14-21-16-8-22(14)2/h3-6,8H,7H2,1-2H3,(H3,15,17,18,19,20)
InChIKey
MCSWDMPGSLFIKN-UHFFFAOYSA-N
Synonyms
496771-26-7
(6Z)6((4METHYLPHENYL)IMINO)4(((4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)16DIHYDRO135TRIAZIN2AMINE
2N(4METHYLPHENYL)6((4METHYL124TRIAZOL3YL)SULFANYLMETHYL)135TRIAZINE24DIAMINE
6(((4methyl4H124triazol3yl)thio)methyl)N2(ptolyl)135triazine24diamine
6(4METHYL4H(124)TRIAZOL3YLSULFANYLMETHYL)NPTOLYL(135)TRIAZINE24DIAMINE
CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CN3C
Cc1ccc(cc1)Nc1nc(CSc2nncn2C)nc(n1)N
InChI=1SC14H16N8Sc193510(649)17131911(1812(15)2013)723142116822(14)2h368H7H212H3(H31517181920)
MFCD03298373
N(4METHYLPHENYL)6(((4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)135TRIAZINE24DIAMINE
STK002742
ZINC000018010935
ZINC00202207
ZINC03857122
ZINC04001228
ZINC18010935

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.