Vitas-M small molecule compound
N-(4-cyanophenyl)-2-{[3-(3-methoxybenzyl)-4-oxo-7-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL193113
SMILES COc1cccc(c1)Cn1c(SCC(=O)Nc2ccc(cc2)C#N)nc2c(c1=O)[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 C29H23N5O3S MW 521.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O3S/c1-37-23-9-5-6-20(14-23)17-34-28(36)27-26(24(16-31-27)21-7-3-2-4-8-21)33-29(34)38-18-25(35)32-22-12-10-19(15-30)11-13-22/h2-14,16,31H,17-18H2,1H3,(H,32,35)InChIKey
DHFWJDFJLRFUEA-UHFFFAOYSA-NSynonyms
1794943-70-61794943706
COC1=CC=CC(=C1)CN2C(=O)C3=C(C(=CN3)C4=CC=CC=C4)N=C2SCC(=O)NC5=CC=C(C=C5)C#N
COc1cccc(c1)Cn1c(SCC(=O)Nc2ccc(cc2)C#N)nc2c(c1=O)(nH)cc2c1ccccc1
InChI=1SC29H23N5O3Sc1372395620(1423)173428(36)2726(24(163127)217324821)3329(34)381825(35)3222121019(1530)111322h2141631H1718H21H3(H3235)
MFCD22390878
N(4cyanophenyl)2((3((3methoxyphenyl)methyl)4oxo7phenyl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4cyanophenyl)2((3(3methoxybenzyl)4oxo7phenyl45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4CYANOPHENYL)2((3(3METHOXYBENZYL)4OXO7PHENYL45DIHYDRO3HPYRROLO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
ZINC000072333412
ZINC72333412
Check stock
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Check stock on Vitas-MAvailable files
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