Vitas-M small molecule compound
2-chloro-4-nitro-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK159082
SMILES O=C(c1ccc(cc1Cl)[N+](=O)[O-])Nc1nnc(s1)CCc1ccccc1
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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 C17H13ClN4O3S MW 388.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O3S/c18-14-10-12(22(24)25)7-8-13(14)16(23)19-17-21-20-15(26-17)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9H2,(H,19,21,23)InChIKey
WEMPXQQPOIAHLL-UHFFFAOYSA-NSynonyms
433261-31-5(2CHLORO4NITROPHENYL)N(5(2PHENYLETHYL)(134THIADIAZOL2YL))CARBOXAMIDE
2CHLORO4NITRON(5(2PHENYLETHYL)134THIADIAZOL2YL)BENZAMIDE
2CHLORO4NITRON(5PHENETHYL134THIADIAZOL2YL)BENZAMIDE
433261315
C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC17H13ClN4O3Sc18141012(22(24)25)7813(14)16(23)1917212015(2617)96114213511h157810H69H2(H192123)
MFCD02868631
O=C(c1ccc(cc1Cl)(N+)(=O)(O))Nc1nnc(s1)CCc1ccccc1
ZINC000001153416
ZINC01153416
ZINC1153416
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