Vitas-M small molecule compound

1-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)thiourea

Catalog ID
STK455300
SMILES S=C(Nc1cccc(c1)[N+](=O)[O-])NCc1ccc2c(c1)OCO2

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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)12-3-1-2-11(7-12)17-15(23)16-8-10-4-5-13-14(6-10)22-9-21-13/h1-7H,8-9H2,(H2,16,17,23)
InChIKey
ZXFSKCIWQHJVLO-UHFFFAOYSA-N
Synonyms

((2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINO)((3NITROPHENYL)AMINO)METHANE1THIONE
1(13benzodioxol5ylmethyl)3(3nitrophenyl)thiourea
C1OC2=C(O1)C=C(C=C2)CNC(=S)NC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC15H13N3O4Sc1918(20)1231211(712)1715(23)16810451314(610)2292113h17H89H2(H2161723)
MFCD04228438
S=C(Nc1cccc(c1)(N+)(=O)(O))NCc1ccc2c(c1)OCO2
ZINC000000612335
ZINC00612335
ZINC612335

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Available files

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