Vitas-M small molecule compound

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

Catalog ID
STK075722
SMILES CCOc1ccc2c(c1)sc(n2)SCc1nc(N)nc(n1)Nc1cccc(c1C)Cl

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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 C20H19ClN6OS2 MW 459.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN6OS2/c1-3-28-12-7-8-15-16(9-12)30-20(24-15)29-10-17-25-18(22)27-19(26-17)23-14-6-4-5-13(21)11(14)2/h4-9H,3,10H2,1-2H3,(H3,22,23,25,26,27)
InChIKey
NWCROGRAQBWOSL-UHFFFAOYSA-N
Synonyms
496773-69-4
(4AMINO6((6ETHOXYBENZOTHIAZOL2YLTHIO)METHYL)(135TRIAZIN2YL))(3CHLORO2METHYLPHENYL)AMINE
(6E)6((3CHLORO2METHYLPHENYL)IMINO)4(((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)METHYL)16DIHYDRO135TRIAZIN2AMINE
2N(3CHLORO2METHYLPHENYL)6((6ETHOXY13BENZOTHIAZOL2YL)SULFANYLMETHYL)135TRIAZINE24DIAMINE
CCOC1=CC2=C(C=C1)N=C(S2)SCC3=NC(=NC(=N3)NC4=C(C(=CC=C4)Cl)C)N
CCOc1ccc2c(c1)sc(n2)SCc1nc(N)nc(n1)Nc1cccc(c1C)Cl
InChI=1SC20H19ClN6OS2c132812781516(912)3020(2415)2910172518(22)2719(2617)231464513(21)11(14)2h49H310H212H3(H32223252627)
MFCD03298601
N(3CHLORO2METHYLPHENYL)6(((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)METHYL)135TRIAZINE24DIAMINE
N2(3chloro2methylphenyl)6(((6ethoxybenzo(d)thiazol2yl)thio)methyl)135triazine24diamine
STK075722
ZINC000017146739
ZINC17146739

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Available files

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