Vitas-M small molecule compound
1-(3-chlorophenyl)-3-[(2E)-5-(4-nitrobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Catalog ID
STL150631
SMILES Clc1cccc(c1)NC(=O)/N=c/1\[nH]nc(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 C16H12ClN5O3S MW 389.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN5O3S/c17-11-2-1-3-12(9-11)18-15(23)19-16-21-20-14(26-16)8-10-4-6-13(7-5-10)22(24)25/h1-7,9H,8H2,(H2,18,19,21,23)InChIKey
ZTNRHEHQHSKJIB-UHFFFAOYSA-NSynonyms
328561-67-7328561677
Clc1cccc(c1)NC(=O)N=c1(nH)nc(s1)Cc1ccc(cc1)(N+)(=O)(O)
MFCD03810355
ZINC000017147488
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