Vitas-M small molecule compound

4-[(2E)-3-phenylprop-2-en-1-yl]-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK741888
SMILES COc1cc(NC(=S)N2CCN(CC2)C/C=C/c2ccccc2)cc(c1OC)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 C23H29N3O3S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O3S/c1-27-20-16-19(17-21(28-2)22(20)29-3)24-23(30)26-14-12-25(13-15-26)11-7-10-18-8-5-4-6-9-18/h4-10,16-17H,11-15H2,1-3H3,(H,24,30)/b10-7+
InChIKey
WQXGJJDBSNLYGK-JXMROGBWSA-N
Synonyms
890173-50-9
4((2E)3phenylprop2en1yl)N(345trimethoxyphenyl)piperazine1carbothioamide
4((E)3PHENYLPROP2ENYL)N(345TRIMETHOXYPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4cinnamylN(345trimethoxyphenyl)piperazine1carbothioamide
890173509
COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCN(CC2)CC=CC3=CC=CC=C3
COc1cc(NC(=S)N2CCN(CC2)CC=Cc2ccccc2)cc(c1OC)OC
InChI=1SC23H29N3O3Sc127201619(1721(282)22(20)293)2423(30)26141225(131526)11710188546918h4101617H1115H213H3(H2430)b107+
MFCD07084309
ZINC000057236063
ZINC57236063

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Available files

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