Vitas-M small molecule compound
(5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-cyclopropyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL055587
SMILES O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)C1CC1
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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 C24H23N3O2S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O2S/c28-22-20(23(29)27(19-9-10-19)24(30)25-22)14-17-8-11-21-18(13-17)7-4-12-26(21)15-16-5-2-1-3-6-16/h1-3,5-6,8,11,13-14,19H,4,7,9-10,12,15H2,(H,25,28,30)/b20-14+InChIKey
KKKINKJXICYEEU-XSFVSMFZSA-NSynonyms
578756-38-4(5E)5((1benzyl1234tetrahydroquinolin6yl)methylidene)1cyclopropyl2sulfanylpyrimidine46(1H5H)dione
(5E)5((1BENZYL34DIHYDRO2HQUINOLIN6YL)METHYLIDENE)1CYCLOPROPYL2SULFANYLIDENE13DIAZINANE46DIONE
578756384
C1CC2=C(C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C4CC4)N(C1)CC5=CC=CC=C5
InChI=1SC24H23N3O2Sc282220(23(29)27(1991019)24(30)2522)14178112118(1317)741226(21)15165213616h1356811131419H479101215H2(H252830)b2014+
MFCD07203162
O=C1N=C(S)N(C(=O)C1=Cc1ccc2c(c1)CCCN2Cc1ccccc1)C1CC1
ZINC000009111572
ZINC9111572
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