Vitas-M small molecule compound
methyl 2-{[(4-nitrophenoxy)acetyl]amino}-4-[4-(propan-2-yl)phenyl]thiophene-3-carboxylate
Catalog ID
STK451592
SMILES COC(=O)c1c(scc1c1ccc(cc1)C(C)C)NC(=O)COc1ccc(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 C23H22N2O6S MW 454.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6S/c1-14(2)15-4-6-16(7-5-15)19-13-32-22(21(19)23(27)30-3)24-20(26)12-31-18-10-8-17(9-11-18)25(28)29/h4-11,13-14H,12H2,1-3H3,(H,24,26)InChIKey
YZIXZPZIFBOQSW-UHFFFAOYSA-NSynonyms
CC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=C(C=C3)(N+)(=O)(O)
COC(=O)c1c(scc1c1ccc(cc1)C(C)C)NC(=O)COc1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H22N2O6Sc114(2)154616(7515)19133222(21(19)23(27)303)2420(26)12311810817(91118)25(28)29h4111314H12H213H3(H2426)
methyl2(((4nitrophenoxy)acetyl)amino)4(4(propan2yl)phenyl)thiophene3carboxylate
METHYL2(((4NITROPHENOXY)ACETYL)AMINO)4(4ISOPROPYLPHENYL)THIOPHENE3CARBOXYLATE
METHYL2((2(4NITROPHENOXY)ACETYL)AMINO)4(4PROPAN2YLPHENYL)THIOPHENE3CARBOXYLATE
METHYL4(4(METHYLETHYL)PHENYL)2(2(4NITROPHENOXY)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02607561
ZINC000000685825
ZINC00685825
ZINC685825
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.