Vitas-M small molecule compound

3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2,3-benzotriazin-4(3H)-one

Catalog ID
STK728907
SMILES O=C(c1cccs1)Cn1nnc2c(c1=O)cccc2

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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 C13H9N3O2S MW 271.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N3O2S/c17-11(12-6-3-7-19-12)8-16-13(18)9-4-1-2-5-10(9)14-15-16/h1-7H,8H2
InChIKey
YBRGDWKEWCMOND-UHFFFAOYSA-N
Synonyms
728885-35-6
123BENZOTRIAZIN4(3H)ONE3(2OXO2(2THIENYL)ETHYL)
3(2OXO2(2THIENYL)ETHYL)BENZO(D)123TRIAZIN4ONE
3(2oxo2(thiophen2yl)ethyl)123benzotriazin4(3H)one
3(2OXO2THIOPHEN2YLETHYL)123BENZOTRIAZIN4ONE
3(2OXO2THIOPHEN2YLETHYL)3HBENZO(D)(123)TRIAZIN4ONE
728885356
C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)C3=CC=CS3
InChI=1SC13H9N3O2Sc1711(126371912)81613(18)9412510(9)141516h17H8H2
MFCD06017811
ZINC000004511995
ZINC04511995
ZINC4511995

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.