Vitas-M small molecule compound
N-[2-(5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)ethyl]-4-chlorobenzamide
Catalog ID
STK223087
SMILES Clc1ccc(cc1)C(=O)NCCc1nnc(n1C)SCC(=O)Nc1nc2c(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 C21H19ClN6O2S2 MW 487.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN6O2S2/c1-28-17(10-11-23-19(30)13-6-8-14(22)9-7-13)26-27-21(28)31-12-18(29)25-20-24-15-4-2-3-5-16(15)32-20/h2-9H,10-12H2,1H3,(H,23,30)(H,24,25,29)InChIKey
NVEPTBCZRANJPX-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=NC3=CC=CC=C3S2)CCNC(=O)C4=CC=C(C=C4)Cl
InChI=1SC21H19ClN6O2S2c12817(10112319(30)136814(22)9713)262721(28)311218(29)25202415423516(15)3220h29H1012H21H3(H2330)(H242529)
MFCD05112091
N(2(5((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)ethyl)4chlorobenzamide
N(2(5(2(13BENZOTHIAZOL2YLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)4CHLOROBENZAMIDE
N(2(5(BENZOTHIAZOL2YLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ETHYL)4CHLOROBENZAMIDE
ZINC000010060507
ZINC10060507
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