Vitas-M small molecule compound
3-{[(2Z)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]carbamoyl}-2,2-dimethylcyclopropanecarboxylic acid
Catalog ID
STL245228
SMILES O=C(C1C(C1(C)C)C(=O)O)/N=c\1/[nH]nc(s1)C1CC1
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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 C12H15N3O3S MW 281.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O3S/c1-12(2)6(7(12)10(17)18)8(16)13-11-15-14-9(19-11)5-3-4-5/h5-7H,3-4H2,1-2H3,(H,17,18)(H,13,15,16)InChIKey
BXTAUBPZMCAGNZ-UHFFFAOYSA-NSynonyms
1324075-68-41324075684
3(((2Z)5cyclopropyl134thiadiazol2(3H)ylidene)carbamoyl)22dimethylcyclopropanecarboxylicacid
3((5cyclopropyl134thiadiazol2yl)carbamoyl)22dimethylcyclopropane1carboxylicacid
CC1(C(C1C(=O)O)C(=O)NC2=NN=C(S2)C3CC3)C
InChI=1SC12H15N3O3Sc112(2)6(7(12)10(17)18)8(16)131115149(1911)5345h57H34H212H3(H1718)(H131516)
MFCD24860191
O=C(C1C(C1(C)C)C(=O)O)N=c1(nH)nc(s1)C1CC1
ZINC000071284956
ZINC000071284959
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