Vitas-M small molecule compound
(3Z)-3-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL441594
SMILES CN1c2ccc(cc2/C(=C/c2cc(n(c2C)c2cccc3c2cccc3)C)/C1=O)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 C30H29N3O4S MW 527.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S/c1-20-17-23(21(2)33(20)29-10-6-8-22-7-4-5-9-25(22)29)18-27-26-19-24(11-12-28(26)31(3)30(27)34)38(35,36)32-13-15-37-16-14-32/h4-12,17-19H,13-16H2,1-3H3/b27-18-InChIKey
JOYSSSDXFNGINR-IMRQLAEWSA-NSynonyms
(3Z)3((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((25DIMETHYL1NAPHTHALEN1YLPYRROL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CC1=CC(=C(N1C2=CC=CC3=CC=CC=C32)C)C=C4C5=C(C=CC(=C5)S(=O)(=O)N6CCOCC6)N(C4=O)C
CN1c2ccc(cc2C(=Cc2cc(n(c2C)c2cccc3c2cccc3)C)C1=O)S(=O)(=O)N1CCOCC1
InChI=1SC30H29N3O4Sc1201723(21(2)33(20)29106822745925(22)29)1827261924(111228(26)31(3)30(27)34)38(3536)32131537161432h4121719H1316H213H3b2718
MFCD07773979
ZINC000008777686
ZINC8777686
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