Vitas-M small molecule compound
propan-2-yl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK087313
SMILES CC(OC(=O)C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)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 C20H25NO3S MW 359.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO3S/c1-11(2)24-19(23)16-12(3)21-13-9-20(4,5)10-14(22)17(13)18(16)15-7-6-8-25-15/h6-8,11,18,21H,9-10H2,1-5H3InChIKey
CZVPQXRYNFNUDE-UHFFFAOYSA-NSynonyms
CC(OC(=O)C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C)C
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CS3)C(=O)OC(C)C
InChI=1SC20H25NO3Sc111(2)2419(23)1612(3)2113920(45)1014(22)17(13)18(16)157682515h68111821H910H215H3
MFCD00770894
propan2yl277trimethyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
propan2yl277trimethyl5oxo4thiophen2yl1468tetrahydroquinoline3carboxylate
STK087313
ZINC000019867023
ZINC000019867027
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