Vitas-M small molecule compound
3,4-dichloro-N-{2-[4-methyl-5-({2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK186830
SMILES O=C(Nc1scc(n1)C)CSc1nnc(n1C)CCNC(=O)c1ccc(c(c1)Cl)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 C18H18Cl2N6O2S2 MW 485.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Cl2N6O2S2/c1-10-8-29-17(22-10)23-15(27)9-30-18-25-24-14(26(18)2)5-6-21-16(28)11-3-4-12(19)13(20)7-11/h3-4,7-8H,5-6,9H2,1-2H3,(H,21,28)(H,22,23,27)InChIKey
KKQSKUUFFXTEAF-UHFFFAOYSA-NSynonyms
34DICHLORON(2(4METHYL5((2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(4METHYL5((2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)THIO)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
34DICHLORON(2(4METHYL5(2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2C)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC18H18Cl2N6O2S2c11082917(2210)2315(27)93018252414(26(18)2)562116(28)113412(19)13(20)711h3478H569H212H3(H2128)(H222327)
MFCD06001870
ZINC000002871436
ZINC02871436
ZINC2871436
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