Vitas-M small molecule compound
3-(3-methoxy-5-nitrophenyl)-2-sulfanylquinazolin-4(3H)-one
Catalog ID
STL171675
SMILES COc1cc(cc(c1)n1c(S)nc2c(c1=O)cccc2)[N+](=O)[O-]
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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 C15H11N3O4S MW 329.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O4S/c1-22-11-7-9(6-10(8-11)18(20)21)17-14(19)12-4-2-3-5-13(12)16-15(17)23/h2-8H,1H3,(H,16,23)InChIKey
KKMKFFFRULWTSF-UHFFFAOYSA-NSynonyms
677013-60-43(3methoxy5nitrophenyl)2sulfanylidene1Hquinazolin4one
3(3methoxy5nitrophenyl)2sulfanylquinazolin4(3H)one
677013604
COC1=CC(=CC(=C1)(N+)(=O)(O))N2C(=O)C3=CC=CC=C3NC2=S
COc1cc(cc(c1)n1c(S)nc2c(c1=O)cccc2)(N+)(=O)(O)
InChI=1SC15H11N3O4Sc1221179(610(811)18(20)21)1714(19)12423513(12)1615(17)23h28H1H3(H1623)
MFCD04046829
ZINC000102437293
ZINC102437293
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