Vitas-M small molecule compound
3-{[(E)-(2,4,6-trioxo-1-phenyltetrahydropyrimidin-5(2H)-ylidene)methyl]amino}benzoic acid
Catalog ID
STL374969
SMILES OC(=O)c1cccc(c1)N/C=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1
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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 C18H13N3O5 MW 351.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O5/c22-15-14(10-19-12-6-4-5-11(9-12)17(24)25)16(23)21(18(26)20-15)13-7-2-1-3-8-13/h1-10,19H,(H,24,25)(H,20,22,26)/b14-10+InChIKey
LFSCZVBXLWBZED-GXDHUFHOSA-NSynonyms
3(((246TRIOXO1PHENYL13DIHYDROPYRIMIDIN5YLIDENE)METHYL)AMINO)BENZOICACID
3(((E)(246TRIOXO1PHENYL13DIAZINAN5YLIDENE)METHYL)AMINO)BENZOICACID
3(((E)(246trioxo1phenyltetrahydropyrimidin5(2H)ylidene)methyl)amino)benzoicacid
C1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC(=C3)C(=O)O)C(=O)NC2=O
InChI=1SC18H13N3O5c221514(10191264511(912)17(24)25)16(23)21(18(26)2015)137213813h11019H(H2425)(H202226)b1410+
MFCD03030626
OC(=O)c1cccc(c1)NC=C1C(=O)NC(=O)N(C1=O)c1ccccc1
ZINC000019681507
ZINC19681507
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