Vitas-M small molecule compound

methyl 2-{[(4-bromophenyl)carbonyl]amino}-5-propylthiophene-3-carboxylate

Catalog ID
STK316798
SMILES CCCc1cc(c(s1)NC(=O)c1ccc(cc1)Br)C(=O)OC

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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 C16H16BrNO3S MW 382.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNO3S/c1-3-4-12-9-13(16(20)21-2)15(22-12)18-14(19)10-5-7-11(17)8-6-10/h5-9H,3-4H2,1-2H3,(H,18,19)
InChIKey
PKADMKUFTLRONT-UHFFFAOYSA-N
Synonyms
445013-49-0
445013490
CCCC1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)Br)C(=O)OC
InChI=1SC16H16BrNO3Sc13412913(16(20)212)15(2212)1814(19)105711(17)8610h59H34H212H3(H1819)
methyl2(((4bromophenyl)carbonyl)amino)5propylthiophene3carboxylate
METHYL2((4BROMOBENZOYL)AMINO)5PROPYL3THIOPHENECARBOXYLATE
METHYL2((4BROMOBENZOYL)AMINO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD02607537
ZINC000000681633
ZINC00681633
ZINC681633

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Available files

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