Vitas-M small molecule compound
(2Z)-2-{[5-(2-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STL366050
SMILES Cc1cc(ccc1c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2)[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 C20H13NO4S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13NO4S/c1-12-10-13(21(23)24)6-8-15(12)17-9-7-14(25-17)11-19-20(22)16-4-2-3-5-18(16)26-19/h2-11H,1H3/b19-11-InChIKey
OBORUNWFHUJZQZ-ODLFYWEKSA-NSynonyms
(2Z)2((5(2methyl4nitrophenyl)furan2yl)methylidene)1benzothiophen3(2H)one
(2Z)2((5(2METHYL4NITROPHENYL)FURAN2YL)METHYLIDENE)1BENZOTHIOPHEN3ONE
2((5(4NITRO2METHYLPHENYL)2FURYL)METHYLENE)1BENZOTHIOPHEN3(2H)ONE
2(5(2METHYL4NITROPHENYL)FURAN2YLMETHYLENE)BENZO(B)THIOPHEN3ONE
CC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)C4=CC=CC=C4S3
Cc1cc(ccc1c1ccc(o1)C=C1Sc2c(C1=O)cccc2)(N+)(=O)(O)
InChI=1SC20H13NO4Sc1121013(21(23)24)6815(12)179714(2517)111920(22)16423518(16)2619h211H1H3b1911
MFCD01030542
ZINC000013616154
ZINC13616154
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