Vitas-M small molecule compound
methyl (2Z)-5-methyl-2-{[(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL407342
SMILES COC(=O)c1[nH]/c(=N/C(=O)Cn2nc3CCCCc3cc2=O)/sc1C
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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 C16H18N4O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4S/c1-9-14(15(23)24-2)18-16(25-9)17-12(21)8-20-13(22)7-10-5-3-4-6-11(10)19-20/h7H,3-6,8H2,1-2H3,(H,17,18,21)InChIKey
QSPWMKDJKBQUHE-UHFFFAOYSA-NSynonyms
1574336-85-81574336858
CC1=C(N=C(S1)NC(=O)CN2C(=O)C=C3CCCCC3=N2)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)Cn2nc3CCCCc3cc2=O)sc1C
InChI=1SC16H18N4O4Sc1914(15(23)242)1816(259)1712(21)82013(22)710534611(10)1920h7H368H212H3(H171821)
methyl(2Z)5methyl2(((3oxo5678tetrahydrocinnolin2(3H)yl)acetyl)imino)23dihydro13thiazole4carboxylate
methyl5methyl2((2(3oxo5678tetrahydrocinnolin2yl)acetyl)amino)13thiazole4carboxylate
MFCD30704695
ZINC000096118558
ZINC96118558
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