Vitas-M small molecule compound
2-{[(phenylcarbonyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Catalog ID
STK720583
SMILES S=C(Nc1sc2c(c1C(=O)O)CCCC2)NC(=O)c1ccccc1
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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 C17H16N2O3S2 MW 360.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O3S2/c20-14(10-6-2-1-3-7-10)18-17(23)19-15-13(16(21)22)11-8-4-5-9-12(11)24-15/h1-3,6-7H,4-5,8-9H2,(H,21,22)(H2,18,19,20,23)InChIKey
AKKSUUAPTQRECG-UHFFFAOYSA-NSynonyms
351161-41-62(((phenylcarbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
2(3benzoylthioureido)4567tetrahydrobenzo(b)thiophene3carboxylicacid
2(benzoylcarbamothioylamino)4567tetrahydro1benzothiophene3carboxylicacid
351161416
C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=CC=CC=C3)C(=O)O
InChI=1SC17H16N2O3S2c2014(106213710)1817(23)191513(16(21)22)11845912(11)2415h1367H4589H2(H2122)(H218192023)
MFCD01955494
ZINC000000870348
ZINC870348
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