Vitas-M small molecule compound
2-chloro-5-({(Z)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)benzoic acid
Catalog ID
STL372473
SMILES Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2ccc(c(c2)C(=O)O)Cl)/C1=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 C19H14ClN3O5 MW 399.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O5/c1-10-2-5-12(6-3-10)23-17(25)14(16(24)22-19(23)28)9-21-11-4-7-15(20)13(8-11)18(26)27/h2-9,21H,1H3,(H,26,27)(H,22,24,28)/b14-9-InChIKey
NUMDPEJYAAXPIO-ZROIWOOFSA-NSynonyms
2CHLORO5(((Z)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)BENZOICACID
2chloro5(((Z)(1(4methylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)benzoicacid
CC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)Cl)C(=O)O)C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)NC(=O)C(=CNc2ccc(c(c2)C(=O)O)Cl)C1=O
InChI=1SC19H14ClN3O5c1102512(6310)2317(25)14(16(24)2219(23)28)921114715(20)13(811)18(26)27h2921H1H3(H2627)(H222428)b149
MFCD01178285
ZINC000020233856
ZINC20233856
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