Vitas-M small molecule compound
(2Z)-2-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STL368465
SMILES Brc1ccc(cc1)n1c(C)cc(c1C)/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 C21H16BrNOS MW 410.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNOS/c1-13-11-15(14(2)23(13)17-9-7-16(22)8-10-17)12-20-21(24)18-5-3-4-6-19(18)25-20/h3-12H,1-2H3/b20-12-InChIKey
FKBZDOMSFYILAX-NDENLUEZSA-NSynonyms
(2Z)2((1(4bromophenyl)25dimethyl1Hpyrrol3yl)methylidene)1benzothiophen3(2H)one
(2Z)2((1(4BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1BENZOTHIOPHEN3ONE
2((1(4BROMOPHENYL)25DIMETHYLPYRROL3YL)METHYLENE)BENZO(B)THIOPHEN3ONE
Brc1ccc(cc1)n1c(C)cc(c1C)C=C1Sc2c(C1=O)cccc2
CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C3C(=O)C4=CC=CC=C4S3
InChI=1SC21H16BrNOSc1131115(14(2)23(13)179716(22)81017)122021(24)18534619(18)2520h312H12H3b2012
MFCD01030548
ZINC000005330553
ZINC05330553
ZINC5330553
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