Vitas-M small molecule compound
N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Catalog ID
STL160454
SMILES O=C(C(n1nnc2c(c1=O)cccc2)C)/N=c\1/[nH]nc(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 C13H12N6O2S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N6O2S/c1-7(11(20)14-13-17-15-8(2)22-13)19-12(21)9-5-3-4-6-10(9)16-18-19/h3-7H,1-2H3,(H,14,17,20)InChIKey
SPSMXPFLXMCFMR-UHFFFAOYSA-NSynonyms
CC1=NN=C(S1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3N=N2
InChI=1SC13H12N6O2Sc17(11(20)141317158(2)2213)1912(21)9534610(9)161819h37H12H3(H141720)
MFCD20759036
N((2Z)5methyl134thiadiazol2(3H)ylidene)2(4oxo123benzotriazin3(4H)yl)propanamide
N(5methyl134thiadiazol2yl)2(4oxo123benzotriazin3yl)propanamide
O=C(C(n1nnc2c(c1=O)cccc2)C)N=c1(nH)nc(s1)C
ZINC000044450483
ZINC000044450484
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