Vitas-M small molecule compound
N~3~-(2-chloro-7H-purin-6-yl)-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Catalog ID
STL244382
SMILES O=C(Nc1nnc(s1)CCc1ccccc1)CCNc1nc(Cl)nc2c1[nH]cn2
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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 C18H17ClN8OS MW 428.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN8OS/c19-17-24-15(14-16(25-17)22-10-21-14)20-9-8-12(28)23-18-27-26-13(29-18)7-6-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,23,27,28)(H2,20,21,22,24,25)InChIKey
HBJDQLDDNVIICE-UHFFFAOYSA-NSynonyms
1351679-26-91351679269
3((2chloro7Hpurin6yl)amino)N(5(2phenylethyl)134thiadiazol2yl)propanamide
3((2chloro9Hpurin6yl)amino)N(5phenethyl134thiadiazol2yl)propanamide
C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)CCNC3=NC(=NC4=C3NC=N4)Cl
InChI=1SC18H17ClN8OSc19172415(1416(2517)22102114)209812(28)2318272613(2918)76114213511h1510H69H2(H232728)(H22021222425)
MFCD24859926
N~3~(2chloro7Hpurin6yl)N(5(2phenylethyl)134thiadiazol2yl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N(5(2PHENYLETHYL)134THIADIAZOL2YL)BETAALANINAMIDE
O=C(Nc1nnc(s1)CCc1ccccc1)CCNc1nc(Cl)nc2c1(nH)cn2
O=C(Nc1nnc(s1)CCc1ccccc1)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000072401333
ZINC72401333
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