Vitas-M small molecule compound
propan-2-yl 2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418467
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
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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 C22H25NO4S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO4S/c1-14(2)27-22(25)20-17-6-4-5-7-18(17)28-21(20)23-19(24)13-10-15-8-11-16(26-3)12-9-15/h8-14H,4-7H2,1-3H3,(H,23,24)/b13-10+InChIKey
LOIGKRVKJJWXRW-JLHYYAGUSA-NSynonyms
353788-86-0353788860
CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=C(C=C3)OC
COc1ccc(cc1)C=CC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
InChI=1SC22H25NO4Sc114(2)2722(25)2017645718(17)2821(20)2319(24)13101581116(263)12915h814H47H213H3(H2324)b1310+
MFCD01920857
propan2yl2(((2E)3(4methoxyphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(((E)3(4methoxyphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000000670377
ZINC00670377
ZINC670377
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