Vitas-M small molecule compound

2-(5-bromo-3-{(Z)-[1-ethyl-5-(morpholin-4-ylsulfonyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]methyl}-1H-indol-1-yl)-N-(3-methoxypropyl)acetamide

Catalog ID
STL448682
SMILES COCCCNC(=O)Cn1cc(c2c1ccc(c2)Br)/C=C\1/c2cc(ccc2N(C1=O)CC)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 C29H33BrN4O6S MW 645.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33BrN4O6S/c1-3-34-27-8-6-22(41(37,38)33-10-13-40-14-11-33)17-24(27)25(29(34)36)15-20-18-32(19-28(35)31-9-4-12-39-2)26-7-5-21(30)16-23(20)26/h5-8,15-18H,3-4,9-14,19H2,1-2H3,(H,31,35)/b25-15-
InChIKey
APWYJARNHATTIG-MYYYXRDXSA-N
Synonyms

2(5bromo3((Z)(1ethyl5(morpholin4ylsulfonyl)2oxo12dihydro3Hindol3ylidene)methyl)1Hindol1yl)N(3methoxypropyl)acetamide
2(5BROMO3((Z)(1ETHYL5MORPHOLIN4YLSULFONYL2OXOINDOL3YLIDENE)METHYL)INDOL1YL)N(3METHOXYPROPYL)ACETAMIDE
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=C4C=C(C=C5)Br)CC(=O)NCCCOC)C1=O
COCCCNC(=O)Cn1cc(c2c1ccc(c2)Br)C=C1c2cc(ccc2N(C1=O)CC)S(=O)(=O)N1CCOCC1
InChI=1SC29H33BrN4O6Sc1334278622(41(3738)33101340141133)1724(27)25(29(34)36)15201832(1928(35)319412392)267521(30)1623(20)26h581518H3491419H212H3(H3135)b2515
MFCD05133686
ZINC000150350782
ZINC150350782

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Available files

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