Vitas-M small molecule compound
N-[(2E)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Catalog ID
STL153268
SMILES CC(c1n[nH]/c(=N\C(=O)c2noc3c2CCCCC3)/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 C14H18N4O2S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N4O2S/c1-8(2)13-16-17-14(21-13)15-12(19)11-9-6-4-3-5-7-10(9)20-18-11/h8H,3-7H2,1-2H3,(H,15,17,19)InChIKey
DQCDWGLGHNGSTR-UHFFFAOYSA-NSynonyms
1282104-71-51282104715
CC(C)C1=NN=C(S1)NC(=O)C2=NOC3=C2CCCCC3
CC(c1n(nH)c(=NC(=O)c2noc3c2CCCCC3)s1)C
InChI=1SC14H18N4O2Sc18(2)13161714(2113)1512(19)1196435710(9)201811h8H37H212H3(H151719)
MFCD20756628
N((2E)5(propan2yl)134thiadiazol2(3H)ylidene)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
N(5propan2yl134thiadiazol2yl)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
ZINC000061721831
ZINC61721831
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