Vitas-M small molecule compound
ethyl 4-({[(3-methyl-4-oxo-7-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL084866
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(c[nH]c2c(=O)n1C)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 C24H22N4O4S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S/c1-3-32-23(31)16-9-11-17(12-10-16)26-19(29)14-33-24-27-20-18(15-7-5-4-6-8-15)13-25-21(20)22(30)28(24)2/h4-13,25H,3,14H2,1-2H3,(H,26,29)InChIKey
RKKPSPHRDUOFII-UHFFFAOYSA-NSynonyms
1040638-70-71040638707
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C)NC=C3C4=CC=CC=C4
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(c(nH)c2c(=O)n1C)c1ccccc1
ethyl4((((3methyl4oxo7phenyl45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2((3methyl4oxo7phenyl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ETHYL4(2((3METHYL4OXO7PHENYL45DIHYDRO3HPYRROLO(32D)PYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
InChI=1SC24H22N4O4Sc133223(31)1691117(121016)2619(29)143324272018(157546815)132521(20)22(30)28(24)2h41325H314H212H3(H2629)
MFCD11995396
ZINC000016840889
ZINC16840889
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