Vitas-M small molecule compound
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2Z)-4-(6-methoxy-1H-indol-3-yl)-1,3-thiazol-2(3H)-ylidene]propanamide
Catalog ID
STL424311
SMILES COc1ccc2c(c1)[nH]cc2c1cs/c(=N\C(=O)CCc2c(C)n[nH]c2C)/[nH]1
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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-11-14(12(2)25-24-11)6-7-19(26)23-20-22-18(10-28-20)16-9-21-17-8-13(27-3)4-5-15(16)17/h4-5,8-10,21H,6-7H2,1-3H3,(H,24,25)(H,22,23,26)InChIKey
AESJMXOAQGBDPX-UHFFFAOYSA-NSynonyms
1676051-66-31676051663
3(35dimethyl1Hpyrazol4yl)N((2Z)4(6methoxy1Hindol3yl)13thiazol2(3H)ylidene)propanamide
CC1=C(C(=NN1)C)CCC(=O)NC2=NC(=CS2)C3=CNC4=C3C=CC(=C4)OC
COc1ccc2c(c1)(nH)cc2c1csc(=NC(=O)CCc2c(C)n(nH)c2C)(nH)1
InChI=1SC20H21N5O2Sc11114(12(2)252411)6719(26)23202218(102820)1692117813(273)4515(16)17h4581021H67H213H3(H2425)(H222326)
MFCD30709298
ZINC000218468151
ZINC218468151
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