Vitas-M small molecule compound
methyl [(4Z)-1-(4-methoxyphenyl)-5-oxo-4-{1-[(thiophen-2-ylmethyl)amino]ethylidene}-4,5-dihydro-1H-pyrazol-3-yl]acetate
Catalog ID
STK234763
SMILES COC(=O)CC1=NN(C(=O)/C/1=C(\NCc1cccs1)/C)c1ccc(cc1)OC
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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/c1-13(21-12-16-5-4-10-28-16)19-17(11-18(24)27-3)22-23(20(19)25)14-6-8-15(26-2)9-7-14/h4-10,21H,11-12H2,1-3H3/b19-13-InChIKey
TZRICCZDJXZUET-UYRXBGFRSA-NSynonyms
CC(=C1C(=NN(C1=O)C2=CC=C(C=C2)OC)CC(=O)OC)NCC3=CC=CS3
COC(=O)CC1=NN(C(=O)C1=C(NCc1cccs1)C)c1ccc(cc1)OC
InChI=1SC20H21N3O4Sc113(21121654102816)1917(1118(24)273)2223(20(19)25)146815(262)9714h41021H1112H213H3b1913
methyl((4Z)1(4methoxyphenyl)5oxo4(1((thiophen2ylmethyl)amino)ethylidene)45dihydro1Hpyrazol3yl)acetate
METHYL2((4Z)1(4METHOXYPHENYL)5OXO4(1(THIOPHEN2YLMETHYLAMINO)ETHYLIDENE)PYRAZOL3YL)ACETATE
METHYL2(1(4METHOXYPHENYL)5OXO4(((2THIENYLMETHYL)AMINO)ETHYLIDENE)12DIAZOLIN3YL)ACETATE
MFCD07597761
ZINC000004999644
ZINC04999644
ZINC4999644
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