Vitas-M small molecule compound
ethyl 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
STL441587
SMILES CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/c2cc(ccc2N(C1=O)C)S(=O)(=O)N1CCOCC1
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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 C29H31N3O6S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O6S/c1-5-38-29(34)21-6-8-23(9-7-21)32-19(2)16-22(20(32)3)17-26-25-18-24(10-11-27(25)30(4)28(26)33)39(35,36)31-12-14-37-15-13-31/h6-11,16-18H,5,12-15H2,1-4H3/b26-17-InChIKey
NNDGXCIXPBAYIB-ONUIUJJFSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C)C
CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1c2cc(ccc2N(C1=O)C)S(=O)(=O)N1CCOCC1
ethyl4(25dimethyl3((Z)(1methyl5(morpholin4ylsulfonyl)2oxo12dihydro3Hindol3ylidene)methyl)1Hpyrrol1yl)benzoate
ETHYL4(25DIMETHYL3((Z)(1METHYL5MORPHOLIN4YLSULFONYL2OXOINDOL3YLIDENE)METHYL)PYRROL1YL)BENZOATE
InChI=1SC29H31N3O6Sc153829(34)216823(9721)3219(2)1622(20(32)3)1726251824(101127(25)30(4)28(26)33)39(3536)31121437151331h6111618H51215H214H3b2617
MFCD07773974
ZINC000008777675
ZINC8777675
Check stock
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Check stock on Vitas-MAvailable files
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