Vitas-M small molecule compound
N-benzyl-2-[(3Z)-3-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetamide
Catalog ID
STK815620
SMILES CCCCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)NCc2ccccc2)/C1=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 C28H31N3O3S2 MW 521.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O3S2/c1-2-3-4-5-6-12-17-30-27(34)25(36-28(30)35)24-21-15-10-11-16-22(21)31(26(24)33)19-23(32)29-18-20-13-8-7-9-14-20/h7-11,13-16H,2-6,12,17-19H2,1H3,(H,29,32)/b25-24-InChIKey
UBQKNQMANCNJQG-IZHYLOQSSA-NSynonyms
CCCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NCC4=CC=CC=C4)SC1=S
CCCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)NCc2ccccc2)C1=O
InChI=1SC28H31N3O3S2c12345612173027(34)25(3628(30)35)24211510111622(21)31(26(24)33)1923(32)291820138791420h7111316H26121719H21H3(H2932)b2524
MFCD04442729
NBENZYL2((3Z)3(3OCTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETAMIDE
Nbenzyl2((3Z)3(3octyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetamide
ZINC000097946527
ZINC97946527
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