Vitas-M small molecule compound
4-(5-amino-1,3,4-thiadiazol-2-yl)-2,2-bis[2-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-1-phenylbutan-1-one
Catalog ID
STK762089
SMILES O=C(C(CCc1nnc(s1)N)(CCc1nnc(s1)N)CCc1nnc(s1)N)c1ccccc1
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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 C20H23N9OS3 MW 501.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N9OS3/c21-17-27-24-13(31-17)6-9-20(10-7-14-25-28-18(22)32-14,11-8-15-26-29-19(23)33-15)16(30)12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,21,27)(H2,22,28)(H2,23,29)InChIKey
JJDAFQRUQCFQBE-UHFFFAOYSA-NSynonyms
4(5amino134thiadiazol2yl)22bis(2(5amino134thiadiazol2yl)ethyl)1phenylbutan1one
C1=CC=C(C=C1)C(=O)C(CCC2=NN=C(S2)N)(CCC3=NN=C(S3)N)CCC4=NN=C(S4)N
InChI=1SC20H23N9OS3c2117272413(3117)6920(10714252818(22)321411815262919(23)3315)16(30)124213512h15H611H2(H22127)(H22228)(H22329)
MFCD01347482
ZINC000002913905
ZINC02913905
ZINC2913905
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