Vitas-M small molecule compound
methyl (2Z)-5-(2-chlorophenyl)-2-{[3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)propanoyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL319072
SMILES COC(=O)c1[nH]/c(=N/C(=O)CCC2NC(=O)c3c(N=C2O)cccc3)/sc1c1ccccc1Cl
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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 C23H19ClN4O5S MW 498.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4O5S/c1-33-22(32)18-19(12-6-2-4-8-14(12)24)34-23(28-18)27-17(29)11-10-16-21(31)25-15-9-5-3-7-13(15)20(30)26-16/h2-9,16H,10-11H2,1H3,(H,25,31)(H,26,30)(H,27,28,29)InChIKey
DIVVICQHHKFEJA-UHFFFAOYSA-NSynonyms
1401533-76-31401533763
COC(=O)c1(nH)c(=NC(=O)CCC2NC(=O)c3c(N=C2O)cccc3)sc1c1ccccc1Cl
COC(=O)C1=C(SC(=N1)NC(=O)CCC2C(=O)NC3=CC=CC=C3C(=O)N2)C4=CC=CC=C4Cl
InChI=1SC23H19ClN4O5Sc13322(32)1819(12624814(12)24)3423(2818)2717(29)11101621(31)2515953713(15)20(30)2616h2916H1011H21H3(H2531)(H2630)(H272829)
methyl(2Z)5(2chlorophenyl)2((3(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)propanoyl)imino)23dihydro13thiazole4carboxylate
methyl5(2chlorophenyl)2(3(25dioxo34dihydro1H14benzodiazepin3yl)propanoylamino)13thiazole4carboxylate
MFCD28031648
ZINC000079478474
ZINC000079478478
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