Vitas-M small molecule compound
ethyl 4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazine-1-carboxylate
Catalog ID
STK462028
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1sc2c(c1Cl)ccc(c2)[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 C16H16ClN3O5S MW 397.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O5S/c1-2-25-16(22)19-7-5-18(6-8-19)15(21)14-13(17)11-4-3-10(20(23)24)9-12(11)26-14/h3-4,9H,2,5-8H2,1H3InChIKey
CVAYQOZOBXCNGF-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)C(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O)
CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)(N+)(=O)(O))Cl
ethyl4((3chloro6nitro1benzothiophen2yl)carbonyl)piperazine1carboxylate
ETHYL4((3CHLORO6NITROBENZO(B)THIOPHEN2YL)CARBONYL)PIPERAZINECARBOXYLATE
ETHYL4(3CHLORO6NITRO1BENZOTHIOPHENE2CARBONYL)PIPERAZINE1CARBOXYLATE
InChI=1SC16H16ClN3O5Sc122516(22)197518(6819)15(21)1413(17)114310(20(23)24)912(11)2614h349H258H21H3
MFCD06004335
ZINC000001053977
ZINC01053977
ZINC1053977
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