Vitas-M small molecule compound
(4E)-1-[3-(dimethylamino)propyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK602201
SMILES CN(CCCN1C(c2cccs2)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)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 C28H30N2O4S MW 490.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O4S/c1-19-7-4-8-20(17-19)18-34-22-12-10-21(11-13-22)26(31)24-25(23-9-5-16-35-23)30(28(33)27(24)32)15-6-14-29(2)3/h4-5,7-13,16-17,25,31H,6,14-15,18H2,1-3H3/b26-24+InChIKey
FVZSUEZVLBSEJQ-SHHOIMCASA-NSynonyms
(4E)1(3(dimethylamino)propyl)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)5(thiophen2yl)pyrrolidine23dione
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5THIOPHEN2YLPYRROLIDINE23DIONE
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC=CS4)O
CN(CCCN1C(c2cccs2)C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C(=O)C1=O)C
InChI=1SC28H30N2O4Sc11974820(1719)183422121021(111322)26(31)2425(2395163523)30(28(33)27(24)32)1561429(2)3h4571316172531H6141518H213H3b2624+
MFCD08731335
ZINC000102693239
ZINC000102693247
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