Vitas-M small molecule compound
methyl (2Z)-5-(propan-2-yl)-2-[(4,5,6,7-tetrahydro-1H-indazol-3-ylcarbonyl)imino]-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL315798
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2n[nH]c3c2CCCC3)/sc1C(C)C
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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 C16H20N4O3S MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O3S/c1-8(2)13-12(15(22)23-3)17-16(24-13)18-14(21)11-9-6-4-5-7-10(9)19-20-11/h8H,4-7H2,1-3H3,(H,19,20)(H,17,18,21)InChIKey
DHZBVJNYSDZQEZ-UHFFFAOYSA-NSynonyms
1435983-81-51435983815
CC(C)C1=C(N=C(S1)NC(=O)C2=NNC3=C2CCCC3)C(=O)OC
InChI=1SC16H20N4O3Sc18(2)1312(15(22)233)1716(2413)1814(21)119645710(9)192011h8H47H213H3(H1920)(H171821)
methyl(2Z)5(propan2yl)2((4567tetrahydro1Hindazol3ylcarbonyl)imino)23dihydro13thiazole4carboxylate
methyl5propan2yl2(4567tetrahydro1Hindazole3carbonylamino)13thiazole4carboxylate
MFCD28027468
ZINC000095477303
ZINC95477303
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