Vitas-M small molecule compound
ethyl 2-({[4-(3-methoxybenzyl)piperazin-1-yl]carbonothioyl}amino)-5-phenylthiophene-3-carboxylate
Catalog ID
STK438827
SMILES CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)Cc1cccc(c1)OC)c1ccccc1
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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 C26H29N3O3S2 MW 495.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3S2/c1-3-32-25(30)22-17-23(20-9-5-4-6-10-20)34-24(22)27-26(33)29-14-12-28(13-15-29)18-19-8-7-11-21(16-19)31-2/h4-11,16-17H,3,12-15,18H2,1-2H3,(H,27,33)InChIKey
WEGPIALHUGRUDH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CCN(CC3)CC4=CC(=CC=C4)OC
ETHYL2(((4((3METHOXYPHENYL)METHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2(((4(3methoxybenzyl)piperazin1yl)carbonothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((4((3METHOXYPHENYL)METHYL)PIPERAZINE1CARBOTHIOYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC26H29N3O3S2c133225(30)221723(2095461020)3424(22)2726(33)29141228(131529)1819871121(1619)312h4111617H3121518H212H3(H2733)
MFCD03945705
ZINC000020168644
ZINC20168644
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