Vitas-M small molecule compound
2-(acenaphtho[1,2-e][1,2,4]triazin-9-ylsulfanyl)-N-(4-nitrophenyl)acetamide
Catalog ID
STK384242
SMILES O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nnc2c(n1)c1cccc3c1c2ccc3
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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 C21H13N5O3S MW 415.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N5O3S/c27-17(22-13-7-9-14(10-8-13)26(28)29)11-30-21-23-19-15-5-1-3-12-4-2-6-16(18(12)15)20(19)24-25-21/h1-10H,11H2,(H,22,27)InChIKey
APUNOANOGCOUPC-UHFFFAOYSA-NSynonyms
2(acenaphtho(12e)(124)triazin9ylsulfanyl)N(4nitrophenyl)acetamide
C1=CC2=C3C(=C1)C4=C(C3=CC=C2)N=NC(=N4)SCC(=O)NC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC21H13N5O3Sc2717(22137914(10813)26(28)29)1130212319155131242616(18(12)15)20(19)242521h110H11H2(H2227)
MFCD02321710
O=C(Nc1ccc(cc1)(N+)(=O)(O))CSc1nnc2c(n1)c1cccc3c1c2ccc3
ZINC000008922384
ZINC08922384
ZINC8922384
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