Vitas-M small molecule compound

4-cyano-3-methyl-5-{[(4-nitrophenyl)acetyl]amino}thiophene-2-carboxamide

Catalog ID
STK452566
SMILES N#Cc1c(NC(=O)Cc2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)N

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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 C15H12N4O4S MW 344.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O4S/c1-8-11(7-16)15(24-13(8)14(17)21)18-12(20)6-9-2-4-10(5-3-9)19(22)23/h2-5H,6H2,1H3,(H2,17,21)(H,18,20)
InChIKey
RJMLMYSKLRSYNV-UHFFFAOYSA-N
Synonyms

4cyano3methyl5(((4nitrophenyl)acetyl)amino)thiophene2carboxamide
4CYANO3METHYL5((2(4NITROPHENYL)ACETYL)AMINO)THIOPHENE2CARBOXAMIDE
4CYANO3METHYL5(2(4NITROPHENYL)ACETYLAMINO)THIOPHENE2CARBOXAMIDE
CC1=C(SC(=C1C#N)NC(=O)CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)N
InChI=1SC15H12N4O4Sc1811(716)15(2413(8)14(17)21)1812(20)692410(539)19(22)23h25H6H21H3(H21721)(H1820)
MFCD02607565
N#Cc1c(NC(=O)Cc2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)N
ZINC000002763446
ZINC02763446
ZINC2763446

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Available files

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