Vitas-M small molecule compound
N-[(5-chloropyridin-2-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK180552
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)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 C15H13ClN4O4S MW 380.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN4O4S/c1-2-24-12-5-3-9(7-11(12)20(22)23)14(21)19-15(25)18-13-6-4-10(16)8-17-13/h3-8H,2H2,1H3,(H2,17,18,19,21,25)InChIKey
XQGVCQHEBIOIDG-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Cl)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(cn1)Cl
InChI=1SC15H13ClN4O4Sc122412539(711(12)20(22)23)14(21)1915(25)18136410(16)81713h38H2H21H3(H21718192125)
MFCD02820552
N((5CHLOROPYRIDIN2YL)CARBAMOTHIOYL)4ETHOXY3NITROBENZAMIDE
ZINC000001173729
ZINC01173729
ZINC1173729
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