Vitas-M small molecule compound
(4-methyl-1,3-thiazol-5-yl)[(7E)-5-methyl-3-(thiophen-2-yl)-7-(thiophen-2-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Catalog ID
STK302151
SMILES CC1C/C(=C\c2cccs2)/C2=NN(C(C2C1)c1cccs1)C(=O)c1scnc1C
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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 C22H21N3OS3 MW 439.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3OS3/c1-13-9-15(11-16-5-3-7-27-16)19-17(10-13)20(18-6-4-8-28-18)25(24-19)22(26)21-14(2)23-12-29-21/h3-8,11-13,17,20H,9-10H2,1-2H3/b15-11+InChIKey
VEDPLASXZAZMKR-RVDMUPIBSA-NSynonyms
1025512-64-4(4methyl13thiazol5yl)((7E)5methyl3(thiophen2yl)7(thiophen2ylmethylidene)33a4567hexahydro2Hindazol2yl)methanone
(4METHYL13THIAZOL5YL)((7E)5METHYL3THIOPHEN2YL7(THIOPHEN2YLMETHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)METHANONE
1025512644
CC1CC(=Cc2cccs2)C2=NN(C(C2C1)c1cccs1)C(=O)c1scnc1C
CC1CC2C(N(N=C2C(=CC3=CC=CS3)C1)C(=O)C4=C(N=CS4)C)C5=CC=CS5
InChI=1SC22H21N3OS3c113915(11165372716)1917(1013)20(186482818)25(2419)22(26)2114(2)23122921h3811131720H910H212H3b1511+
MFCD03467304
ZINC000013881940
ZINC000169620063
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