Vitas-M small molecule compound
2-[(3-{(E)-[3-(3-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-indol-1-yl)methyl]benzonitrile
Catalog ID
STK153457
SMILES N#Cc1ccccc1Cn1cc(c2c1cccc2)/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)[N+](=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 C27H18N4O4S MW 494.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N4O4S/c28-14-19-7-1-2-8-20(19)16-29-17-21(23-10-3-4-11-24(23)29)13-25-26(32)30(27(33)36-25)15-18-6-5-9-22(12-18)31(34)35/h1-13,17H,15-16H2/b25-13+InChIKey
YJBUZBUIDBOGGO-DHRITJCHSA-NSynonyms
2((3((E)(3((3nitrophenyl)methyl)24dioxo13thiazolidin5ylidene)methyl)indol1yl)methyl)benzonitrile
2((3((E)(3(3NITROBENZYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)1HINDOL1YL)METHYL)BENZONITRILE
C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=O)S4)CC5=CC(=CC=C5)(N+)(=O)(O))C#N
InChI=1SC27H18N4O4Sc281419712820(19)16291721(2310341124(23)29)132526(32)30(27(33)3625)151865922(1218)31(34)35h11317H1516H2b2513+
MFCD03068468
N#Cc1ccccc1Cn1cc(c2c1cccc2)C=C1SC(=O)N(C1=O)Cc1cccc(c1)(N+)(=O)(O)
ZINC000009720717
ZINC09720717
ZINC9720717
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