Vitas-M small molecule compound
2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STK650015
SMILES COCc1n[nH]/c(=N\C(=O)Cc2c(=O)oc3c(c2C)cc(c(c3)OC)Cl)/s1
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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 C17H16ClN3O5S MW 409.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O5S/c1-8-9-4-11(18)13(25-3)6-12(9)26-16(23)10(8)5-14(22)19-17-21-20-15(27-17)7-24-2/h4,6H,5,7H2,1-3H3,(H,19,21,22)InChIKey
RANJJJUHQBDTDI-UHFFFAOYSA-NSynonyms
1144463-27-31144463273
2(6chloro7methoxy4methyl2oxo2Hchromen3yl)N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)acetamide
2(6chloro7methoxy4methyl2oxochromen3yl)N(5(methoxymethyl)134thiadiazol2yl)acetamide
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC3=NN=C(S3)COC
COCc1n(nH)c(=NC(=O)Cc2c(=O)oc3c(c2C)cc(c(c3)OC)Cl)s1
InChI=1SC17H16ClN3O5Sc189411(18)13(253)612(9)2616(23)10(8)514(22)1917212015(2717)7242h46H57H213H3(H192122)
MFCD18165471
ZINC000031812731
ZINC31812731
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