Vitas-M small molecule compound
N-[(5-chloropyridin-2-yl)carbamothioyl]-2-(morpholin-4-yl)-5-nitrobenzamide
Catalog ID
STK398824
SMILES S=C(NC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-])Nc1ccc(cn1)Cl
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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 C17H16ClN5O4S MW 421.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN5O4S/c18-11-1-4-15(19-10-11)20-17(28)21-16(24)13-9-12(23(25)26)2-3-14(13)22-5-7-27-8-6-22/h1-4,9-10H,5-8H2,(H2,19,20,21,24,28)InChIKey
HYUVGLWAXURPHU-UHFFFAOYSA-NSynonyms
C1COCCN1C2=C(C=C(C=C2)(N+)(=O)(O))C(=O)NC(=S)NC3=NC=C(C=C3)Cl
InChI=1SC17H16ClN5O4Sc18111415(191011)2017(28)2116(24)13912(23(25)26)2314(13)2257278622h14910H58H2(H21920212428)
MFCD06632637
N((5chloropyridin2yl)carbamothioyl)2(morpholin4yl)5nitrobenzamide
N((5CHLOROPYRIDIN2YL)CARBAMOTHIOYL)2MORPHOLIN4YL5NITROBENZAMIDE
S=C(NC(=O)c1cc(ccc1N1CCOCC1)(N+)(=O)(O))Nc1ccc(cn1)Cl
ZINC000015919217
ZINC15919217
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