Vitas-M small molecule compound
3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[(2Z)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]propanamide
Catalog ID
STK935408
SMILES O=C(/N=c\1/[nH]nc(s1)CCc1ccccc1)CCn1nnc2c(c1=O)cccc2
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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 C20H18N6O2S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O2S/c27-17(12-13-26-19(28)15-8-4-5-9-16(15)22-25-26)21-20-24-23-18(29-20)11-10-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,21,24,27)InChIKey
HYEIMIBRDJJFRA-UHFFFAOYSA-NSynonyms
1219539-71-51219539715
3(4oxo123benzotriazin3(4H)yl)N((2Z)5(2phenylethyl)134thiadiazol2(3H)ylidene)propanamide
3(4oxo123benzotriazin3yl)N(5(2phenylethyl)134thiadiazol2yl)propanamide
C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)CCN3C(=O)C4=CC=CC=C4N=N3
InChI=1SC20H18N6O2Sc2717(12132619(28)15845916(15)222526)2120242318(2920)1110146213714h19H1013H2(H212427)
MFCD18178059
O=C(N=c1(nH)nc(s1)CCc1ccccc1)CCn1nnc2c(c1=O)cccc2
ZINC000040266986
ZINC40266986
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