Vitas-M small molecule compound
6-[({4-amino-5-[1-(2,4-dichlorophenoxy)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-N,N-dimethyl-1,3,5-triazine-2,4-diamine
Catalog ID
STK664544
SMILES Nc1nc(CSc2nnc(n2N)C(Oc2ccc(cc2Cl)Cl)C)nc(n1)N(C)C
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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 C16H19Cl2N9OS MW 456.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19Cl2N9OS/c1-8(28-11-5-4-9(17)6-10(11)18)13-24-25-16(27(13)20)29-7-12-21-14(19)23-15(22-12)26(2)3/h4-6,8H,7,20H2,1-3H3,(H2,19,21,22,23)InChIKey
XYFCPUQSZVARMN-UHFFFAOYSA-NSynonyms
6(((4amino5(1(24dichlorophenoxy)ethyl)4H124triazol3yl)sulfanyl)methyl)NNdimethyl135triazine24diamine
6((4AMINO5(1(24DICHLOROPHENOXY)ETHYL)124TRIAZOL3YL)SULFANYLMETHYL)2N2NDIMETHYL135TRIAZINE24DIAMINE
CC(C1=NN=C(N1N)SCC2=NC(=NC(=N2)N(C)C)N)OC3=C(C=C(C=C3)Cl)Cl
InChI=1SC16H19Cl2N9OSc18(2811549(17)610(11)18)13242516(27(13)20)297122114(19)2315(2212)26(2)3h468H720H213H3(H219212223)
MFCD05855455
ZINC000012401973
ZINC000012401974
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