Vitas-M small molecule compound
2-methyl-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK086605
SMILES S=C(NC(=O)c1cccc(c1C)[N+](=O)[O-])NCCCN1CCOCC1
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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 C16H22N4O4S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O4S/c1-12-13(4-2-5-14(12)20(22)23)15(21)18-16(25)17-6-3-7-19-8-10-24-11-9-19/h2,4-5H,3,6-11H2,1H3,(H2,17,18,21,25)InChIKey
FRKFJMTWLOSRTJ-UHFFFAOYSA-NSynonyms
1(2METHYL3NITROBENZOYL)3(3MORPHOLIN4YLPROPYL)THIOUREA
2METHYLN((3(MORPHOLIN4YL)PROPYL)CARBAMOTHIOYL)3NITROBENZAMIDE
2METHYLN(3MORPHOLIN4YLPROPYLCARBAMOTHIOYL)3NITROBENZAMIDE
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC(=S)NCCCN2CCOCC2
InChI=1SC16H22N4O4Sc11213(42514(12)20(22)23)15(21)1816(25)17637198102411919h245H3611H21H3(H217182125)
MFCD03110184
S=C(NC(=O)c1cccc(c1C)(N+)(=O)(O))NCCCN1CCOCC1
STK086605
ZINC000019913933
ZINC19913933
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