Vitas-M small molecule compound

methyl 2-({(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK419712
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)C(C)C)sc2c1CCCC2

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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 C22H25NO3S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO3S/c1-14(2)16-11-8-15(9-12-16)10-13-19(24)23-21-20(22(25)26-3)17-6-4-5-7-18(17)27-21/h8-14H,4-7H2,1-3H3,(H,23,24)/b13-10+
InChIKey
VISIDOUTYOQOKW-JLHYYAGUSA-N
Synonyms
445286-26-0
445286260
CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC
COC(=O)c1c(NC(=O)C=Cc2ccc(cc2)C(C)C)sc2c1CCCC2
InChI=1SC22H25NO3Sc114(2)1611815(91216)101319(24)232120(22(25)263)17645718(17)2721h814H47H213H3(H2324)b1310+
methyl2(((2E)3(4(propan2yl)phenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((E)3(4propan2ylphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02371897
ZINC000002753044
ZINC02753044
ZINC2753044

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Available files

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