Vitas-M small molecule compound
methyl 4-(2,5-dimethyl-3-{(Z)-[1-methyl-5-(morpholin-4-ylsulfonyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]methyl}-1H-pyrrol-1-yl)benzoate
Catalog ID
STL441586
SMILES COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N(c2c1cc(cc2)S(=O)(=O)N1CCOCC1)C
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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 C28H29N3O6S MW 535.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O6S/c1-18-15-21(19(2)31(18)22-7-5-20(6-8-22)28(33)36-4)16-25-24-17-23(9-10-26(24)29(3)27(25)32)38(34,35)30-11-13-37-14-12-30/h5-10,15-17H,11-14H2,1-4H3/b25-16-InChIKey
TWKYCEUQQQPBPW-XYGWBWBKSA-NSynonyms
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C
COC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N(c2c1cc(cc2)S(=O)(=O)N1CCOCC1)C
InChI=1SC28H29N3O6Sc1181521(19(2)31(18)227520(6822)28(33)364)1625241723(91026(24)29(3)27(25)32)38(3435)30111337141230h5101517H1114H214H3b2516
methyl4(25dimethyl3((Z)(1methyl5(morpholin4ylsulfonyl)2oxo12dihydro3Hindol3ylidene)methyl)1Hpyrrol1yl)benzoate
METHYL4(25DIMETHYL3((Z)(1METHYL5MORPHOLIN4YLSULFONYL2OXOINDOL3YLIDENE)METHYL)PYRROL1YL)BENZOATE
MFCD07773973
ZINC000008777673
ZINC8777673
Check stock
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Check stock on Vitas-MAvailable files
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