Vitas-M small molecule compound
methyl 3-({[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL144295
SMILES COC(=O)c1cccc(c1)NC(=O)CSc1ncnc2c1[nH]cc2c1ccccc1
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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 C22H18N4O3S MW 418.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O3S/c1-29-22(28)15-8-5-9-16(10-15)26-18(27)12-30-21-20-19(24-13-25-21)17(11-23-20)14-6-3-2-4-7-14/h2-11,13,23H,12H2,1H3,(H,26,27)InChIKey
LQGHFNHZWLRWSJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC=NC3=C2NC=C3C4=CC=CC=C4
COC(=O)c1cccc(c1)NC(=O)CSc1ncnc2c1(nH)cc2c1ccccc1
InChI=1SC22H18N4O3Sc12922(28)1585916(1015)2618(27)1230212019(24132521)17(112320)146324714h2111323H12H21H3(H2627)
methyl3((((7phenyl5Hpyrrolo(32d)pyrimidin4yl)sulfanyl)acetyl)amino)benzoate
METHYL3((((7PHENYL5HPYRROLO(32D)PYRIMIDIN4YL)THIO)ACETYL)AMINO)BENZOATE
methyl3((2((7phenyl5Hpyrrolo(32d)pyrimidin4yl)sulfanyl)acetyl)amino)benzoate
MFCD20750571
ZINC000033291866
ZINC33291866
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