Vitas-M small molecule compound

4-[(3-carbamoyl-4,5-dihydronaphtho[1,2-b]thiophen-2-yl)amino]-4-oxobutanoic acid

Catalog ID
STK466709
SMILES OC(=O)CCC(=O)Nc1sc2c(c1C(=O)N)CCc1c2cccc1

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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 C17H16N2O4S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4S/c18-16(23)14-11-6-5-9-3-1-2-4-10(9)15(11)24-17(14)19-12(20)7-8-13(21)22/h1-4H,5-8H2,(H2,18,23)(H,19,20)(H,21,22)
InChIKey
UBPUPCLYVZYJKW-UHFFFAOYSA-N
Synonyms

3(N(3CARBAMOYL45DIHYDROBENZO(G)BENZO(B)THIOPHEN2YL)CARBAMOYL)PROPANOICACID
4((3carbamoyl45dihydrobenzo(g)(1)benzothiol2yl)amino)4oxobutanoicacid
4((3carbamoyl45dihydronaphtho(12b)thiophen2yl)amino)4oxobutanoicacid
C1CC2=C(C3=CC=CC=C31)SC(=C2C(=O)N)NC(=O)CCC(=O)O
InChI=1SC17H16N2O4Sc1816(23)1411659312410(9)15(11)2417(14)1912(20)7813(21)22h14H58H2(H21823)(H1920)(H2122)
MFCD06026104
ZINC000017071832
ZINC17071832

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Available files

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