Vitas-M small molecule compound

methyl 2-{[(2,2-dichloro-1-methylcyclopropyl)carbonyl]amino}-5-methyl-4-phenylthiophene-3-carboxylate

Catalog ID
STK451159
SMILES COC(=O)c1c(NC(=O)C2(C)CC2(Cl)Cl)sc(c1c1ccccc1)C

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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 C18H17Cl2NO3S MW 398.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2NO3S/c1-10-12(11-7-5-4-6-8-11)13(15(22)24-3)14(25-10)21-16(23)17(2)9-18(17,19)20/h4-8H,9H2,1-3H3,(H,21,23)
InChIKey
IYTUSHSDADWFPI-UHFFFAOYSA-N
Synonyms

CC1=C(C(=C(S1)NC(=O)C2(CC2(Cl)Cl)C)C(=O)OC)C3=CC=CC=C3
InChI=1SC18H17Cl2NO3Sc11012(117546811)13(15(22)243)14(2510)2116(23)17(2)918(1719)20h48H9H213H3(H2123)
methyl2(((22dichloro1methylcyclopropyl)carbonyl)amino)5methyl4phenylthiophene3carboxylate
METHYL2((22DICHLORO1METHYLCYCLOPROPANECARBONYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
METHYL2((22DICHLORO1METHYLCYCLOPROPYL)CARBONYLAMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
MFCD03072938
ZINC000002763052
ZINC000002763053

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.