Vitas-M small molecule compound
methyl (4Z)-1-[2-(4-methoxyphenyl)ethyl]-2-methyl-4-{[5-({[(4-methylphenyl)sulfonyl]amino}methyl)furan-2-yl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK074651
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(o1)CNS(=O)(=O)c1ccc(cc1)C)CCc1ccc(cc1)OC
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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 C29H30N2O7S MW 550.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O7S/c1-19-5-13-25(14-6-19)39(34,35)30-18-24-12-11-23(38-24)17-26-27(29(33)37-4)20(2)31(28(26)32)16-15-21-7-9-22(36-3)10-8-21/h5-14,17,30H,15-16,18H2,1-4H3/b26-17-InChIKey
YTORBKFSVZIGRO-ONUIUJJFSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(O2)C=C3C(=C(N(C3=O)CCC4=CC=C(C=C4)OC)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(o1)CNS(=O)(=O)c1ccc(cc1)C)CCc1ccc(cc1)OC
InChI=1SC29H30N2O7Sc11951325(14619)39(3435)301824121123(3824)172627(29(33)374)20(2)31(28(26)32)1615217922(363)10821h5141730H151618H214H3b2617
METHYL(4Z)1(2(4METHOXYPHENYL)ETHYL)2METHYL4((5((((4METHYLPHENYL)SULFONYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)1(2(4METHOXYPHENYL)ETHYL)2METHYL4((5(((4METHYLPHENYL)SULFONYLAMINO)METHYL)FURAN2YL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
MFCD08679492
STK074651
ZINC000097958993
ZINC97958993
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