Vitas-M small molecule compound

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-nitrophenyl)thiourea

Catalog ID
STK421514
SMILES S=C(Nc1ccc2c(c1)OCCO2)Nc1ccc(cc1)[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 C15H13N3O4S MW 331.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O4S/c19-18(20)12-4-1-10(2-5-12)16-15(23)17-11-3-6-13-14(9-11)22-8-7-21-13/h1-6,9H,7-8H2,(H2,16,17,23)
InChIKey
PRKRYSLYSKLSKE-UHFFFAOYSA-N
Synonyms
701948-58-5
1(23dihydro14benzodioxin6yl)3(4nitrophenyl)thiourea
701948585
C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H13N3O4Sc1918(20)124110(2512)1615(23)1711361314(911)22872113h169H78H2(H2161723)
MFCD04129011
S=C(Nc1ccc2c(c1)OCCO2)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000005041277
ZINC05041277
ZINC5041277

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Available files

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