Vitas-M small molecule compound
4-{[3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK085651
SMILES O=C(Nc1sc2c(c1C(=O)Nc1cccc3c1cccc3)CCCC2)CCC(=O)O
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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 C23H22N2O4S MW 422.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4S/c26-19(12-13-20(27)28)25-23-21(16-9-3-4-11-18(16)30-23)22(29)24-17-10-5-7-14-6-1-2-8-15(14)17/h1-2,5-8,10H,3-4,9,11-13H2,(H,24,29)(H,25,26)(H,27,28)InChIKey
HPLMMRSZDPBPTF-UHFFFAOYSA-NSynonyms
4((3(naphthalen1ylcarbamoyl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
C1CCC2=C(C1)C(=C(S2)NC(=O)CCC(=O)O)C(=O)NC3=CC=CC4=CC=CC=C43
InChI=1SC23H22N2O4Sc2619(121320(27)28)252321(169341118(16)3023)22(29)2417105714612815(14)17h125810H3491113H2(H2429)(H2526)(H2728)
MFCD01989487
O=C(Nc1sc2c(c1C(=O)Nc1cccc3c1cccc3)CCCC2)CCC(=O)O
STK085651
ZINC000000722400
ZINC722400
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