Vitas-M small molecule compound
1-{(4E)-6-amino-4-[(3-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}-3-[(4-chlorophenyl)sulfanyl]propan-2-one
Catalog ID
STK846931
SMILES O=C(Cc1nc(N)[nH]/c(=N\c2cccc(c2)C)/n1)CSc1ccc(cc1)Cl
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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 C19H18ClN5OS MW 399.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5OS/c1-12-3-2-4-14(9-12)22-19-24-17(23-18(21)25-19)10-15(26)11-27-16-7-5-13(20)6-8-16/h2-9H,10-11H2,1H3,(H3,21,22,23,24,25)InChIKey
VSBDFZOVIPJCMJ-UHFFFAOYSA-NSynonyms
489445-01-41((4E)6amino4((3methylphenyl)imino)45dihydro135triazin2yl)3((4chlorophenyl)sulfanyl)propan2one
1(4AMINO6((3METHYLPHENYL)AMINO)135TRIAZIN2YL)3((4CHLOROPHENYL)THIO)ACETONE
1(4AMINO6(3METHYLANILINO)135TRIAZIN2YL)3(4CHLOROPHENYL)SULFANYLPROPAN2ONE
489445014
CC1=CC(=CC=C1)NC2=NC(=NC(=N2)N)CC(=O)CSC3=CC=C(C=C3)Cl
InChI=1SC19H18ClN5OSc11232414(912)22192417(2318(21)2519)1015(26)1127167513(20)6816h29H1011H21H3(H32122232425)
MFCD03794853
O=C(Cc1nc(N)(nH)c(=Nc2cccc(c2)C)n1)CSc1ccc(cc1)Cl
ZINC000001819194
ZINC01237026
ZINC01819194
ZINC1819194
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