Vitas-M small molecule compound
(3-chloro-6-nitro-1-benzothiophen-2-yl)(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Catalog ID
STK007104
SMILES COc1ccc2c(c1)C(C)CC(N2C(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])(C)C
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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 C22H21ClN2O4S MW 444.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O4S/c1-12-11-22(2,3)24(17-8-6-14(29-4)10-16(12)17)21(26)20-19(23)15-7-5-13(25(27)28)9-18(15)30-20/h5-10,12H,11H2,1-4H3InChIKey
KKQLOHPYUZBDND-UHFFFAOYSA-NSynonyms
314039-83-3(3CHLORO6NITRO1BENZOTHIOPHEN2YL)(6METHOXY224TRIMETHYL34DIHYDROQUINOLIN1(2H)YL)METHANONE
(3CHLORO6NITRO1BENZOTHIOPHEN2YL)(6METHOXY224TRIMETHYL34DIHYDROQUINOLIN1YL)METHANONE
(3chloro6nitrobenzo(b)thiophen2yl)(6methoxy224trimethyl34dihydroquinolin1(2H)yl)methanone
314039833
CC1CC(N(C2=C1C=C(C=C2)OC)C(=O)C3=C(C4=C(S3)C=C(C=C4)(N+)(=O)(O))Cl)(C)C
COc1ccc2c(c1)C(C)CC(N2C(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))(C)C
InChI=1SC22H21ClN2O4Sc1121122(23)24(178614(294)1016(12)17)21(26)2019(23)157513(25(27)28)918(15)3020h51012H11H214H3
MFCD01796231
STK007104
ZINC000001188656
ZINC000001188658
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