Vitas-M small molecule compound

N-(4-chlorobenzyl)-2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide

Catalog ID
STK985829
SMILES O=C(NCc1ccc(cc1)Cl)CSc1nc2[nH]ncc2c(=O)n1c1ccccc1

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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 C20H16ClN5O2S MW 425.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O2S/c21-14-8-6-13(7-9-14)10-22-17(27)12-29-20-24-18-16(11-23-25-18)19(28)26(20)15-4-2-1-3-5-15/h1-9,11H,10,12H2,(H,22,27)(H,23,25)
InChIKey
HGUVYPFBWXKBTI-UHFFFAOYSA-N
Synonyms

C1=CC=C(C=C1)N2C(=O)C3=C(NN=C3)N=C2SCC(=O)NCC4=CC=C(C=C4)Cl
InChI=1SC20H16ClN5O2Sc21148613(7914)102217(27)122920241816(11232518)19(28)26(20)154213515h1911H1012H2(H2227)(H2325)
MFCD18182769
N((4chlorophenyl)methyl)2((4oxo5phenyl1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
N(4chlorobenzyl)2((4oxo5phenyl45dihydro1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
O=C(NCc1ccc(cc1)Cl)CSc1nc2(nH)ncc2c(=O)n1c1ccccc1
ZINC000051316742
ZINC51316742

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Available files

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