Vitas-M small molecule compound

2-[(6-nitro-1,3-benzoxazol-2-yl)sulfanyl]-1-(piperidin-1-yl)ethanone

Catalog ID
STK699992
SMILES O=C(N1CCCCC1)CSc1nc2c(o1)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 C14H15N3O4S MW 321.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O4S/c18-13(16-6-2-1-3-7-16)9-22-14-15-11-5-4-10(17(19)20)8-12(11)21-14/h4-5,8H,1-3,6-7,9H2
InChIKey
GRCYPJHUIQBVBH-UHFFFAOYSA-N
Synonyms
372091-30-0
2((6nitro13benzoxazol2yl)sulfanyl)1(piperidin1yl)ethanone
2((6NITRO13BENZOXAZOL2YL)SULFANYL)1PIPERIDIN1YLETHANONE
2((6nitrobenzo(d)oxazol2yl)thio)1(piperidin1yl)ethanone
372091300
C1CCN(CC1)C(=O)CSC2=NC3=C(O2)C=C(C=C3)(N+)(=O)(O)
InChI=1SC14H15N3O4Sc1813(166213716)9221415115410(17(19)20)812(11)2114h458H13679H2
MFCD01877914
O=C(N1CCCCC1)CSc1nc2c(o1)cc(cc2)(N+)(=O)(O)
ZINC000000500708
ZINC00500708
ZINC500708

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Available files

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