Vitas-M small molecule compound
[(3Z)-3-(6,7-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetic acid
Catalog ID
STK676576
SMILES OC(=O)CN1c2ccccc2/C(=c\2/sc3n(c2=O)c2c(n3)cc(c(c2)C)C)/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 C21H15N3O4S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O4S/c1-10-7-13-15(8-11(10)2)24-20(28)18(29-21(24)22-13)17-12-5-3-4-6-14(12)23(19(17)27)9-16(25)26/h3-8H,9H2,1-2H3,(H,25,26)/b18-17-InChIKey
WXTXGJBLLJCKGT-ZCXUNETKSA-NSynonyms
((3Z)3(67dimethyl3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)2oxo23dihydro1Hindol1yl)aceticacid
2((3Z)3(67DIMETHYL1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)2OXOINDOL1YL)ACETICACID
2(3(67DIMETHYL3OXO(13THIAZOLIDINO(32A)BENZIMIDAZOL2YLIDENE))2OXOBENZO(D)AZOLINYL)ACETICACID
CC1=CC2=C(C=C1C)N3C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)SC3=N2
InChI=1SC21H15N3O4Sc11071315(811(10)2)2420(28)18(2921(24)2213)1712534614(12)23(19(17)27)916(25)26h38H9H212H3(H2526)b1817
MFCD02110713
OC(=O)CN1c2ccccc2C(=c2sc3n(c2=O)c2c(n3)cc(c(c2)C)C)C1=O
ZINC000003671577
ZINC3671577
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