Vitas-M small molecule compound
(2Z)-2-[3-nitro-4-(piperidin-1-yl)benzylidene]-1-benzothiophen-3(2H)-one
Catalog ID
STK377020
SMILES [O-][N+](=O)c1cc(ccc1N1CCCCC1)/C=C/1\Sc2c(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 C20H18N2O3S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O3S/c23-20-15-6-2-3-7-18(15)26-19(20)13-14-8-9-16(17(12-14)22(24)25)21-10-4-1-5-11-21/h2-3,6-9,12-13H,1,4-5,10-11H2/b19-13-InChIKey
VVYKXNXXFZSMQX-UYRXBGFRSA-NSynonyms
(2Z)2((3NITRO4PIPERIDIN1YLPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(3nitro4(piperidin1yl)benzylidene)1benzothiophen3(2H)one
(O)(N+)(=O)c1cc(ccc1N1CCCCC1)C=C1Sc2c(C1=O)cccc2
C1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)C4=CC=CC=C4S3)(N+)(=O)(O)
InChI=1SC20H18N2O3Sc232015623718(15)2619(20)13148916(17(1214)22(24)25)21104151121h23691213H1451011H2b1913
MFCD01446248
ZINC000004046446
ZINC04046446
ZINC4046446
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