Vitas-M small molecule compound
3-({[(3-iodophenyl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid
Catalog ID
STK102402
SMILES S=C(Nc1cc(ccc1C)C(=O)O)NC(=O)c1cccc(c1)I
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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/c1-9-5-6-11(15(21)22)8-13(9)18-16(23)19-14(20)10-3-2-4-12(17)7-10/h2-8H,1H3,(H,21,22)(H2,18,19,20,23)InChIKey
GOUMWKBNPQYUBE-UHFFFAOYSA-NSynonyms
3((((3IODOPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)4METHYLBENZOICACID
3((3IODOBENZOYL)CARBAMOTHIOYLAMINO)4METHYLBENZOICACID
CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC(=CC=C2)I
InChI=1SC16H13IN2O3Sc195611(15(21)22)813(9)1816(23)1914(20)1032412(17)710h28H1H3(H2122)(H218192023)
MFCD03245863
ZINC000001158704
ZINC1158704
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