Vitas-M small molecule compound
1,3-diphenyl-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK999924
SMILES S=C1N(c2ccccc2)C(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C(=O)N1c1ccccc1
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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 C29H25N3O2S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O2S/c33-27-25(19-20-17-21-9-7-15-30-16-8-10-22(18-20)26(21)30)28(34)32(24-13-5-2-6-14-24)29(35)31(27)23-11-3-1-4-12-23/h1-6,11-14,17-19H,7-10,15-16H2InChIKey
KCMXAVVGGOLIMQ-UHFFFAOYSA-NSynonyms
489400-02-413diphenyl5(2367tetrahydro1H5Hpyrido(321ij)quinolin9ylmethylidene)2thioxodihydropyrimidine46(1H5H)dione
489400024
5((123567hexahydropyrido(321ij)quinolin9yl)methylene)13diphenyl2thioxodihydropyrimidine46(1H5H)dione
C1CC2=CC(=CC3=C2N(C1)CCC3)C=C4C(=O)N(C(=S)N(C4=O)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC29H25N3O2Sc332725(192017219715301681022(1820)26(21)30)28(34)32(24135261424)29(35)31(27)23113141223h1611141719H7101516H2
MFCD03295815
S=C1N(c2ccccc2)C(=O)C(=Cc2cc3CCCN4c3c(c2)CCC4)C(=O)N1c1ccccc1
ZINC000002248436
ZINC02248436
ZINC2248436
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