Vitas-M small molecule compound
methyl 2-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-carbamoyl-4-methylthiophene-3-carboxylate
Catalog ID
STK458912
SMILES COC(=O)c1c(NC(=O)CN2CCN(CC2)Cc2ccccc2)sc(c1C)C(=O)N
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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 C21H26N4O4S MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O4S/c1-14-17(21(28)29-2)20(30-18(14)19(22)27)23-16(26)13-25-10-8-24(9-11-25)12-15-6-4-3-5-7-15/h3-7H,8-13H2,1-2H3,(H2,22,27)(H,23,26)InChIKey
QSOIVKIITBJZQW-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)C(=O)N
InChI=1SC21H26N4O4Sc11417(21(28)292)20(3018(14)19(22)27)2316(26)132510824(91125)12156435715h37H813H212H3(H22227)(H2326)
methyl2(((4benzylpiperazin1yl)acetyl)amino)5carbamoyl4methylthiophene3carboxylate
methyl2((2(4benzylpiperazin1yl)acetyl)amino)5carbamoyl4methylthiophene3carboxylate
MFCD06050395
ZINC000023477224
ZINC23477224
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