Vitas-M small molecule compound
5-iodo-2-({[(2-methylphenyl)carbonyl]carbamothioyl}amino)benzoic acid
Catalog ID
STK107077
SMILES S=C(Nc1ccc(cc1C(=O)O)I)NC(=O)c1ccccc1C
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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 C16H13IN2O3S MW 440.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13IN2O3S/c1-9-4-2-3-5-11(9)14(20)19-16(23)18-13-7-6-10(17)8-12(13)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,23)InChIKey
FHJWJSZFTIYKRK-UHFFFAOYSA-NSynonyms
531541-11-4531541114
5IODO2((((2METHYLPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
5IODO2((2METHYLBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
BENZOICACID5IODO2((((2METHYLBENZOYL)AMINO)THIOXOMETHYL)AMINO)
CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)I)C(=O)O
InChI=1SC16H13IN2O3Sc19423511(9)14(20)1916(23)18137610(17)812(13)15(21)22h28H1H3(H2122)(H218192023)
MFCD03567219
ZINC000009763742
ZINC9763742
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