Vitas-M small molecule compound
(3Z)-3-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-1-ethyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL477336
SMILES CCN1C(=O)/C(=C\c2cc(n(c2C)c2ccccc2)C)/c2c1ccc(c2)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 C27H29N3O4S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S/c1-4-29-26-11-10-23(35(32,33)28-12-14-34-15-13-28)18-24(26)25(27(29)31)17-21-16-19(2)30(20(21)3)22-8-6-5-7-9-22/h5-11,16-18H,4,12-15H2,1-3H3/b25-17-InChIKey
YDDLXGKRUHHMNI-UQQQWYQISA-NSynonyms
(3Z)3((25dimethyl1phenyl1Hpyrrol3yl)methylidene)1ethyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((25DIMETHYL1PHENYLPYRROL3YL)METHYLIDENE)1ETHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=C(N(C(=C4)C)C5=CC=CC=C5)C)C1=O
InChI=1SC27H29N3O4Sc142926111023(35(3233)28121434151328)1824(26)25(27(29)31)17211619(2)30(20(21)3)228657922h5111618H41215H213H3b2517
MFCD05133830
ZINC000008778109
ZINC8778109
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