Vitas-M small molecule compound
3-chloro-N-[5-(4-nitrobenzyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK018647
SMILES Clc1cccc(c1)C(=O)Nc1nnc(s1)Cc1ccc(cc1)[N+](=O)[O-]
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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 C16H11ClN4O3S MW 374.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN4O3S/c17-12-3-1-2-11(9-12)15(22)18-16-20-19-14(25-16)8-10-4-6-13(7-5-10)21(23)24/h1-7,9H,8H2,(H,18,20,22)InChIKey
CGKLDQHSTKIMRK-UHFFFAOYSA-NSynonyms
3CHLORON((2E)5(4NITROBENZYL)134THIADIAZOL2(3H)YLIDENE)BENZAMIDE
3CHLORON(5((4NITROPHENYL)METHYL)134THIADIAZOL2YL)BENZAMIDE
3CHLORON(5(4NITROBENZYL)134THIADIAZOL2YL)BENZAMIDE
C1=CC(=CC(=C1)Cl)C(=O)NC2=NN=C(S2)CC3=CC=C(C=C3)(N+)(=O)(O)
Clc1cccc(c1)C(=O)Nc1nnc(s1)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H11ClN4O3Sc171231211(912)15(22)1816201914(2516)8104613(7510)21(23)24h179H8H2(H182022)
MFCD02034363
STK018647
ZINC000002301504
ZINC02301504
ZINC2301504
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