Vitas-M small molecule compound

2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Catalog ID
STK744797
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1sc2c(c1C(=O)O)CCCC2

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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 C19H19NO4S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4S/c1-24-13-9-6-12(7-10-13)8-11-16(21)20-18-17(19(22)23)14-4-2-3-5-15(14)25-18/h6-11H,2-5H2,1H3,(H,20,21)(H,22,23)/b11-8+
InChIKey
OUNVWYSIBMTJAE-DHZHZOJOSA-N
Synonyms
312940-84-4
(E)2(3(4methoxyphenyl)acrylamido)4567tetrahydrobenzo(b)thiophene3carboxylicacid
2(((2E)3(4methoxyphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
2(((E)3(4methoxyphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
312940844
COC1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O
COc1ccc(cc1)C=CC(=O)Nc1sc2c(c1C(=O)O)CCCC2
InChI=1SC19H19NO4Sc124139612(71013)81116(21)201817(19(22)23)14423515(14)2518h611H25H21H3(H2021)(H2223)b118+
MFCD01917737
ZINC000001000339
ZINC1000339

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Available files

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