Vitas-M small molecule compound
2-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STK660017
SMILES CC(Cc1n[nH]/c(=N\C(=O)Cc2c(=O)oc3c(c2C)cc2c(c3)occ2C)/s1)C
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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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-10(2)5-19-23-24-21(29-19)22-18(25)7-15-12(4)14-6-13-11(3)9-27-16(13)8-17(14)28-20(15)26/h6,8-10H,5,7H2,1-4H3,(H,22,24,25)InChIKey
PDVOTEFBANKMHF-UHFFFAOYSA-NSynonyms
1190247-85-81190247858
2(35dimethyl7oxo7Hfuro(32g)chromen6yl)N((2E)5(2methylpropyl)134thiadiazol2(3H)ylidene)acetamide
2(35dimethyl7oxofuro(32g)chromen6yl)N(5(2methylpropyl)134thiadiazol2yl)acetamide
CC(Cc1n(nH)c(=NC(=O)Cc2c(=O)oc3c(c2C)cc2c(c3)occ2C)s1)C
CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)NC4=NN=C(S4)CC(C)C)C
InChI=1SC21H21N3O4Sc110(2)519232421(2919)2218(25)71512(4)1461311(3)92716(13)817(14)2820(15)26h6810H57H214H3(H222425)
MFCD18168917
ZINC000036353297
ZINC36353297
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