Vitas-M small molecule compound
N-{[3-chloro-2-(pyrrolidin-1-yl)phenyl]carbamothioyl}-2-nitrobenzamide
Catalog ID
STK389708
SMILES S=C(Nc1cccc(c1N1CCCC1)Cl)NC(=O)c1ccccc1[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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c19-13-7-5-8-14(16(13)22-10-3-4-11-22)20-18(27)21-17(24)12-6-1-2-9-15(12)23(25)26/h1-2,5-9H,3-4,10-11H2,(H2,20,21,24,27)InChIKey
PSVJLWRPTCGVKM-UHFFFAOYSA-NSynonyms
C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
InChI=1SC18H17ClN4O3Sc191375814(16(13)2210341122)2018(27)2117(24)12612915(12)23(25)26h1259H341011H2(H220212427)
MFCD05831876
N((3chloro2(pyrrolidin1yl)phenyl)carbamothioyl)2nitrobenzamide
N((3CHLORO2PYRROLIDIN1YLPHENYL)CARBAMOTHIOYL)2NITROBENZAMIDE
S=C(Nc1cccc(c1N1CCCC1)Cl)NC(=O)c1ccccc1(N+)(=O)(O)
ZINC000001063861
ZINC01063861
ZINC1063861
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