Vitas-M small molecule compound

(2E)-but-2-en-1-yl 6-(4-chlorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK405774
SMILES C/C=C/COC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)Cl

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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 C20H20ClNO3 MW 357.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO3/c1-3-4-9-25-20(24)19-12(2)18-16(22-19)10-14(11-17(18)23)13-5-7-15(21)8-6-13/h3-8,14,22H,9-11H2,1-2H3/b4-3+
InChIKey
ZJXJEOGJZZPLGA-ONEGZZNKSA-N
Synonyms

((E)but2enyl)6(4chlorophenyl)3methyl4oxo1567tetrahydroindole2carboxylate
(2E)but2en1yl6(4chlorophenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
(2E)BUT2ENYL6(4CHLOROPHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
CC=CCOC(=O)c1(nH)c2c(c1C)C(=O)CC(C2)c1ccc(cc1)Cl
CC=CCOC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C
InChI=1SC20H20ClNO3c13492520(24)1912(2)1816(2219)1014(1117(18)23)135715(21)8613h381422H911H212H3b43+
MFCD06754365
ZINC000004912142
ZINC000004912148

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Available files

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