Vitas-M small molecule compound
N-[(2Z)-4-(5-methoxy-2-methyl-1H-indol-3-yl)-1,3-thiazol-2(3H)-ylidene]-2,2-dimethyl-5-oxotetrahydrofuran-3-carboxamide
Catalog ID
STL423961
SMILES COc1ccc2c(c1)c(c1cs/c(=N\C(=O)C3CC(=O)OC3(C)C)/[nH]1)c([nH]2)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 C20H21N3O4S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S/c1-10-17(12-7-11(26-4)5-6-14(12)21-10)15-9-28-19(22-15)23-18(25)13-8-16(24)27-20(13,2)3/h5-7,9,13,21H,8H2,1-4H3,(H,22,23,25)InChIKey
AEYXDBIRJURKBA-UHFFFAOYSA-NSynonyms
1676086-33-11676086331
CC1=C(C2=C(N1)C=CC(=C2)OC)C3=CSC(=N3)NC(=O)C4CC(=O)OC4(C)C
COc1ccc2c(c1)c(c1csc(=NC(=O)C3CC(=O)OC3(C)C)(nH)1)c((nH)2)C
InChI=1SC20H21N3O4Sc11017(12711(264)5614(12)2110)1592819(2215)2318(25)13816(24)2720(132)3h5791321H8H214H3(H222325)
MFCD30709097
N((2Z)4(5methoxy2methyl1Hindol3yl)13thiazol2(3H)ylidene)22dimethyl5oxotetrahydrofuran3carboxamide
N(4(5methoxy2methyl1Hindol3yl)13thiazol2yl)22dimethyl5oxooxolane3carboxamide
ZINC000218494153
ZINC000218494234
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