Vitas-M small molecule compound
dimethyl 2-{[(4-benzylpiperazin-1-yl)carbonothioyl]amino}benzene-1,4-dicarboxylate
Catalog ID
STK868377
SMILES COC(=O)c1ccc(cc1NC(=S)N1CCN(CC1)Cc1ccccc1)C(=O)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 C22H25N3O4S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4S/c1-28-20(26)17-8-9-18(21(27)29-2)19(14-17)23-22(30)25-12-10-24(11-13-25)15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3,(H,23,30)InChIKey
HNIASLQSYZLBTQ-UHFFFAOYSA-NSynonyms
717833-21-1717833211
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCN(CC2)CC3=CC=CC=C3
dimethyl2(((4benzylpiperazin1yl)carbonothioyl)amino)benzene14dicarboxylate
DIMETHYL2((4BENZYLPIPERAZINE1CARBOTHIOYL)AMINO)BENZENE14DICARBOXYLATE
dimethyl2(4benzylpiperazine1carbothioamido)terephthalate
InChI=1SC22H25N3O4Sc12820(26)178918(21(27)292)19(1417)2322(30)25121024(111325)15166435716h3914H101315H212H3(H2330)
MFCD06006750
ZINC000020481920
ZINC20481920
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