Vitas-M small molecule compound

N-[2-methoxy-4-({[(4-nitrophenyl)carbonyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide

Catalog ID
STK390194
SMILES COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=S)NC(=O)c1ccc(cc1)[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 C24H18N4O6S MW 490.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O6S/c1-33-20-13-16(25-24(35)27-22(29)14-6-9-17(10-7-14)28(31)32)8-11-18(20)26-23(30)21-12-15-4-2-3-5-19(15)34-21/h2-13H,1H3,(H,26,30)(H2,25,27,29,35)
InChIKey
FBSPATZSKWCSHE-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))NC(=O)C3=CC4=CC=CC=C4O3
COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=S)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H18N4O6Sc133201316(2524(35)2722(29)146917(10714)28(31)32)81118(20)2623(30)211215423519(15)3421h213H1H3(H2630)(H225272935)
MFCD02624995
N(((4(BENZO(D)FURAN2YLCARBONYLAMINO)3METHOXYPHENYL)AMINO)THIOXOMETHYL)(4NITROPHENYL)CARBOXAMIDE
N(2methoxy4((((4nitrophenyl)carbonyl)carbamothioyl)amino)phenyl)1benzofuran2carboxamide
N(2METHOXY4((4NITROBENZOYL)CARBAMOTHIOYLAMINO)PHENYL)1BENZOFURAN2CARBOXAMIDE
ZINC000003770822
ZINC03770822
ZINC3770822

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Available files

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