Vitas-M small molecule compound
ethyl 4-({(Z)-[2,4,6-trioxo-1-(thiophen-2-ylmethyl)tetrahydropyrimidin-5(2H)-ylidene]methyl}amino)benzoate
Catalog ID
STL372452
SMILES CCOC(=O)c1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)Cc1cccs1
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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 C19H17N3O5S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5S/c1-2-27-18(25)12-5-7-13(8-6-12)20-10-15-16(23)21-19(26)22(17(15)24)11-14-4-3-9-28-14/h3-10,20H,2,11H2,1H3,(H,21,23,26)/b15-10-InChIKey
WWZWEHNOYFRDLT-GDNBJRDFSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=CS3
CCOC(=O)c1ccc(cc1)NC=C1C(=O)NC(=O)N(C1=O)Cc1cccs1
ETHYL4(((Z)(246TRIOXO1(THIOPHEN2YLMETHYL)13DIAZINAN5YLIDENE)METHYL)AMINO)BENZOATE
ethyl4(((Z)(246trioxo1(thiophen2ylmethyl)tetrahydropyrimidin5(2H)ylidene)methyl)amino)benzoate
InChI=1SC19H17N3O5Sc122718(25)125713(8612)20101516(23)2119(26)22(17(15)24)11144392814h31020H211H21H3(H212326)b1510
MFCD03711046
ZINC000003003949
ZINC03003949
ZINC3003949
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