Vitas-M small molecule compound
N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzamide
Catalog ID
STK650466
SMILES CC(Cc1n[nH]/c(=N/C(=O)c2ccc(cc2)n2nnc3c(c2=O)cccc3)/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 C20H18N6O2S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O2S/c1-12(2)11-17-23-24-20(29-17)21-18(27)13-7-9-14(10-8-13)26-19(28)15-5-3-4-6-16(15)22-25-26/h3-10,12H,11H2,1-2H3,(H,21,24,27)InChIKey
SPCDJKFBNOJTCX-UHFFFAOYSA-NSynonyms
1190283-21-61190283216
CC(C)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=N3
CC(Cc1n(nH)c(=NC(=O)c2ccc(cc2)n2nnc3c(c2=O)cccc3)s1)C
InChI=1SC20H18N6O2Sc112(2)1117232420(2917)2118(27)137914(10813)2619(28)15534616(15)222526h31012H11H212H3(H212427)
MFCD18165624
N((2Z)5(2methylpropyl)134thiadiazol2(3H)ylidene)4(4oxo123benzotriazin3(4H)yl)benzamide
N(5(2methylpropyl)134thiadiazol2yl)4(4oxo123benzotriazin3yl)benzamide
ZINC000036360004
ZINC36360004
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