Vitas-M small molecule compound
N-(3-nitrophenyl)-2-(9H-purin-6-ylsulfanyl)acetamide
Catalog ID
STK233076
SMILES O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1ncnc2c1nc[nH]2
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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 C13H10N6O3S MW 330.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N6O3S/c20-10(18-8-2-1-3-9(4-8)19(21)22)5-23-13-11-12(15-6-14-11)16-7-17-13/h1-4,6-7H,5H2,(H,18,20)(H,14,15,16,17)InChIKey
BCWRPLHAVDRYQM-UHFFFAOYSA-NSynonyms
879620-60-7879620607
C1=CC(=CC(=C1)(N+)(=O)(O))NC(=O)CSC2=NC=NC3=C2NC=N3
InChI=1SC13H10N6O3Sc2010(1882139(48)19(21)22)523131112(1561411)1671713h1467H5H2(H1820)(H14151617)
MFCD08683686
N(3nitrophenyl)2(7Hpurin6ylsulfanyl)acetamide
N(3nitrophenyl)2(9Hpurin6ylsulfanyl)acetamide
O=C(Nc1cccc(c1)(N+)(=O)(O))CSc1ncnc2c1nc(nH)2
ZINC000008018764
ZINC08018764
ZINC8018764
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