Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-4-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]piperazine-1-carbothioamide
Catalog ID
STK486850
SMILES Clc1ccc2c(c1)sc(c2Cl)C(=O)N1CCN(CC1)C(=S)Nc1ccc2c(c1)OCO2
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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 C21H17Cl2N3O3S2 MW 494.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3O3S2/c22-12-1-3-14-17(9-12)31-19(18(14)23)20(27)25-5-7-26(8-6-25)21(30)24-13-2-4-15-16(10-13)29-11-28-15/h1-4,9-10H,5-8,11H2,(H,24,30)InChIKey
CXCOZUCCFMMHDQ-UHFFFAOYSA-NSynonyms
4((2HBENZO(34D)13DIOXOLAN5YLAMINO)THIOXOMETHYL)PIPERAZINYL36DICHLOROBENZO(B)THIOPHEN2YLKETONE
C1CN(CCN1C(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C(=S)NC4=CC5=C(C=C4)OCO5
InChI=1SC21H17Cl2N3O3S2c2212131417(912)3119(18(14)23)20(27)255726(8625)21(30)2413241516(1013)29112815h14910H5811H2(H2430)
MFCD05137650
N(13benzodioxol5yl)4((36dichloro1benzothiophen2yl)carbonyl)piperazine1carbothioamide
N(13benzodioxol5yl)4(36dichloro1benzothiophene2carbonyl)piperazine1carbothioamide
ZINC000013330406
ZINC13330406
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