Vitas-M small molecule compound
N-[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamide
Catalog ID
STK940136
SMILES COCc1n[nH]/c(=N/C(=O)Cc2c(=O)oc3c(c2C)cc2c(c3C)occ2C)/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 C20H19N3O5S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5S/c1-9-7-27-17-11(3)18-13(5-12(9)17)10(2)14(19(25)28-18)6-15(24)21-20-23-22-16(29-20)8-26-4/h5,7H,6,8H2,1-4H3,(H,21,23,24)InChIKey
QYFPHMKQQUEMPT-UHFFFAOYSA-NSynonyms
1219554-53-61219554536
CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CC(=O)NC4=NN=C(S4)COC)C)C
COCc1n(nH)c(=NC(=O)Cc2c(=O)oc3c(c2C)cc2c(c3C)occ2C)s1
InChI=1SC20H19N3O5Sc197271711(3)1813(512(9)17)10(2)14(19(25)2818)615(24)2120232216(2920)8264h57H68H214H3(H212324)
MFCD18179450
N((2Z)5(methoxymethyl)134thiadiazol2(3H)ylidene)2(359trimethyl7oxo7Hfuro(32g)chromen6yl)acetamide
N(5(methoxymethyl)134thiadiazol2yl)2(359trimethyl7oxofuro(32g)chromen6yl)acetamide
ZINC000040287743
ZINC40287743
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