Vitas-M small molecule compound
5-(carbamothioylamino)-2-chlorobenzoic acid
Catalog ID
STL303842
SMILES NC(=S)Nc1ccc(c(c1)C(=O)O)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 C8H7ClN2O2S MW 230.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H7ClN2O2S/c9-6-2-1-4(11-8(10)14)3-5(6)7(12)13/h1-3H,(H,12,13)(H3,10,11,14)InChIKey
DQHMKUUXHZHRLI-UHFFFAOYSA-NSynonyms
361365-15-32CHLORO5THIOUREIDOBENZOICACID
361365153
5(carbamothioylamino)2chlorobenzoicacid
C1=CC(=C(C=C1NC(=S)N)C(=O)O)Cl
InChI=1SC8H7ClN2O2Sc96214(118(10)14)35(6)7(12)13h13H(H1213)(H3101114)
MFCD02647003
ZINC000005756821
ZINC5756821
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