Vitas-M small molecule compound

ethyl 2-{[(2E)-2,3-diphenylprop-2-enoyl]amino}-5-(1-phenylethyl)thiophene-3-carboxylate

Catalog ID
STK301950
SMILES CCOC(=O)c1cc(sc1NC(=O)/C(=C/c1ccccc1)/c1ccccc1)C(c1ccccc1)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 C30H27NO3S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27NO3S/c1-3-34-30(33)26-20-27(21(2)23-15-9-5-10-16-23)35-29(26)31-28(32)25(24-17-11-6-12-18-24)19-22-13-7-4-8-14-22/h4-21H,3H2,1-2H3,(H,31,32)/b25-19+
InChIKey
XTSAFHIDJLTCTI-NCELDCMTSA-N
Synonyms
512812-12-3
512812123
CCOC(=O)C1=C(SC(=C1)C(C)C2=CC=CC=C2)NC(=O)C(=CC3=CC=CC=C3)C4=CC=CC=C4
CCOC(=O)c1cc(sc1NC(=O)C(=Cc1ccccc1)c1ccccc1)C(c1ccccc1)C
ethyl2(((2E)23diphenylprop2enoyl)amino)5(1phenylethyl)thiophene3carboxylate
ETHYL2(((E)23DIPHENYLPROP2ENOYL)AMINO)5(1PHENYLETHYL)THIOPHENE3CARBOXYLATE
ETHYL2((23DIPHENYLACRYLOYL)AMINO)5(1PHENYLETHYL)3THIOPHENECARBOXYLATE
InChI=1SC30H27NO3Sc133430(33)262027(21(2)231595101623)3529(26)3128(32)25(2417116121824)1922137481422h421H3H212H3(H3132)b2519+
MFCD03466360
ZINC000002749536
ZINC000002749538

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Available files

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