Vitas-M small molecule compound

2-({[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3-benzothiazole

Catalog ID
STK129321
SMILES [O-][N+](=O)c1cccc(c1)c1nnc(o1)CSc1nc2c(s1)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 C16H10N4O3S2 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N4O3S2/c21-20(22)11-5-3-4-10(8-11)15-19-18-14(23-15)9-24-16-17-12-6-1-2-7-13(12)25-16/h1-8H,9H2
InChIKey
XBHSRAUYASHSCC-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)c1nnc(o1)CSc1nc2c(s1)cccc2
2(((5(3NITROPHENYL)134OXADIAZOL2YL)METHYL)SULFANYL)13BENZOTHIAZOLE
2(13BENZOTHIAZOL2YLSULFANYLMETHYL)5(3NITROPHENYL)134OXADIAZOLE
C1=CC=C2C(=C1)N=C(S2)SCC3=NN=C(O3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC16H10N4O3S2c2120(22)1153410(811)15191814(2315)924161712612713(12)2516h18H9H2
MFCD07555135
ZINC000004700632
ZINC04700632
ZINC4700632

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Available files

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