Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-({1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368185
SMILES Brc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)CC(=O)N2CCCc3c2cccc3)/C1=O
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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 C30H23BrN4O3S MW 599.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23BrN4O3S/c31-21-11-13-22(14-12-21)35-29(38)24(28(37)32-30(35)39)16-20-17-33(26-10-4-2-8-23(20)26)18-27(36)34-15-5-7-19-6-1-3-9-25(19)34/h1-4,6,8-14,16-17H,5,7,15,18H2,(H,32,37,39)/b24-16+InChIKey
LUBHLMVASRBAFJ-LFVJCYFKSA-NSynonyms
(5E)1(4BROMOPHENYL)5((1(2(34DIHYDRO2HQUINOLIN1YL)2OXOETHYL)INDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4bromophenyl)5((1(2(34dihydroquinolin1(2H)yl)2oxoethyl)1Hindol3yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
1(4BROMOPHENYL)5((1(2(34DIHYDRO1(2H)QUINOLINYL)2OXOETHYL)1HINDOL3YL)METHYLENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
Brc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cn(c3c2cccc3)CC(=O)N2CCCc3c2cccc3)C1=O
C1CC2=CC=CC=C2N(C1)C(=O)CN3C=C(C4=CC=CC=C43)C=C5C(=O)NC(=S)N(C5=O)C6=CC=C(C=C6)Br
InChI=1SC30H23BrN4O3Sc3121111322(141221)3529(38)24(28(37)3230(35)39)16201733(261042823(20)26)1827(36)34155719613925(19)34h1468141617H571518H2(H323739)b2416+
MFCD03083652
ZINC000000638074
ZINC638074
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