Vitas-M small molecule compound
methyl 4-({[2-(1H-imidazol-4-yl)ethyl]carbamothioyl}amino)benzoate
Catalog ID
STK207233
SMILES COC(=O)c1ccc(cc1)NC(=S)NCCc1nc[nH]c1
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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 C14H16N4O2S MW 304.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O2S/c1-20-13(19)10-2-4-11(5-3-10)18-14(21)16-7-6-12-8-15-9-17-12/h2-5,8-9H,6-7H2,1H3,(H,15,17)(H2,16,18,21)InChIKey
WPEXHDQPGZELRR-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CN=CN2
COC(=O)c1ccc(cc1)NC(=S)NCCc1nc(nH)c1
InChI=1SC14H16N4O2Sc12013(19)102411(5310)1814(21)16761281591712h2589H67H21H3(H1517)(H2161821)
METHYL4((((2IMIDAZOL4YLETHYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
methyl4(((2(1Himidazol4yl)ethyl)carbamothioyl)amino)benzoate
METHYL4(2(1HIMIDAZOL5YL)ETHYLCARBAMOTHIOYLAMINO)BENZOATE
MFCD06754499
ZINC000004741443
ZINC4741443
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