Vitas-M small molecule compound
methyl 2-chloro-5-({(Z)-[1-(3-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)benzoate
Catalog ID
STL359415
SMILES COC(=O)c1cc(N/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)Cl)ccc1Cl
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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 C19H13Cl2N3O5 MW 434.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl2N3O5/c1-29-18(27)13-8-11(5-6-15(13)21)22-9-14-16(25)23-19(28)24(17(14)26)12-4-2-3-10(20)7-12/h2-9,22H,1H3,(H,23,25,28)/b14-9-InChIKey
GZRNJAMAQOQDRQ-ZROIWOOFSA-NSynonyms
COC(=O)C1=C(C=CC(=C1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl)Cl
COC(=O)c1cc(NC=C2C(=O)NC(=O)N(C2=O)c2cccc(c2)Cl)ccc1Cl
InChI=1SC19H13Cl2N3O5c12918(27)13811(5615(13)21)2291416(25)2319(28)24(17(14)26)1242310(20)712h2922H1H3(H232528)b149
methyl2chloro5(((Z)(1(3chlorophenyl)246trioxo13diazinan5ylidene)methyl)amino)benzoate
methyl2chloro5(((Z)(1(3chlorophenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)benzoate
MFCD28033688
ZINC000095471517
ZINC95471517
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