Vitas-M small molecule compound
3-methyl-2-nitro-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK260542
SMILES O=C(c1cccc(c1[N+](=O)[O-])C)Nc1nnc(s1)CCCOc1ccccc1
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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 C19H18N4O4S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O4S/c1-13-7-5-10-15(17(13)23(25)26)18(24)20-19-22-21-16(28-19)11-6-12-27-14-8-3-2-4-9-14/h2-5,7-10H,6,11-12H2,1H3,(H,20,22,24)InChIKey
SWVBVUNJARSEKS-UHFFFAOYSA-NSynonyms
893250-58-3(3METHYL2NITROPHENYL)N(5(3PHENOXYPROPYL)(134THIADIAZOL2YL))CARBOXAMIDE
3methyl2nitroN(5(3phenoxypropyl)134thiadiazol2yl)benzamide
893250583
CC1=CC=CC(=C1(N+)(=O)(O))C(=O)NC2=NN=C(S2)CCCOC3=CC=CC=C3
InChI=1SC19H18N4O4Sc113751015(17(13)23(25)26)18(24)2019222116(2819)1161227148324914h25710H61112H21H3(H202224)
MFCD07152276
O=C(c1cccc(c1(N+)(=O)(O))C)Nc1nnc(s1)CCCOc1ccccc1
ZINC000009426493
ZINC09426493
ZINC9426493
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