Vitas-M small molecule compound
[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl](phenyl)methanone
Catalog ID
STK760799
SMILES O=C(c1ccccc1)N1CCN(CC1)c1nc2c(s1)cc(cc2)[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 C18H16N4O3S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3S/c23-17(13-4-2-1-3-5-13)20-8-10-21(11-9-20)18-19-15-7-6-14(22(24)25)12-16(15)26-18/h1-7,12H,8-11H2InChIKey
CMCDEDANRYBTJD-UHFFFAOYSA-NSynonyms
(4(6nitro13benzothiazol2yl)piperazin1yl)(phenyl)methanone
(4(6NITRO13BENZOTHIAZOL2YL)PIPERAZIN1YL)PHENYLMETHANONE
2(4BENZOYL1PIPERAZINYL)6NITRO13BENZOTHIAZOLE
4(6NITROBENZOTHIAZOL2YL)PIPERAZINYLPHENYLKETONE
C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)(N+)(=O)(O))C(=O)C4=CC=CC=C4
InChI=1SC18H16N4O3Sc2317(134213513)2081021(11920)1819157614(22(24)25)1216(15)2618h1712H811H2
MFCD01819703
O=C(c1ccccc1)N1CCN(CC1)c1nc2c(s1)cc(cc2)(N+)(=O)(O)
ZINC000000715063
ZINC00715063
ZINC715063
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