Vitas-M small molecule compound
3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(2-phenylethyl)propanamide
Catalog ID
STK619641
SMILES O=C(CCSc1nc(Cl)nc2c1[nH]cn2)NCCc1ccccc1
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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 C16H16ClN5OS MW 361.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5OS/c17-16-21-14-13(19-10-20-14)15(22-16)24-9-7-12(23)18-8-6-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,18,23)(H,19,20,21,22)InChIKey
CJHUODJQYYELMT-UHFFFAOYSA-NSynonyms
929834-99-13((2chloro7Hpurin6yl)sulfanyl)N(2phenylethyl)propanamide
3((2chloro9Hpurin6yl)thio)Nphenethylpropanamide
929834991
C1=CC=C(C=C1)CCNC(=O)CCSC2=NC(=NC3=C2NC=N3)Cl
InChI=1SC16H16ClN5OSc1716211413(19102014)15(2216)249712(23)1886114213511h1510H69H2(H1823)(H19202122)
MFCD09796891
O=C(CCSc1nc(Cl)nc2c1(nH)cn2)NCCc1ccccc1
O=C(CCSc1nc(Cl)nc2c1nc(nH)2)NCCc1ccccc1
ZINC000008992559
ZINC08992559
ZINC8992559
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