Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide
Catalog ID
STK473494
SMILES S=C(N1CCN(CC1)c1ccc(c(c1)Cl)Cl)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 C18H17Cl2N3O2S MW 410.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N3O2S/c19-14-3-2-13(10-15(14)20)22-5-7-23(8-6-22)18(26)21-12-1-4-16-17(9-12)25-11-24-16/h1-4,9-10H,5-8,11H2,(H,21,26)InChIKey
KADVVIKTUYKWJI-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLAMINO)(4(34DICHLOROPHENYL)PIPERAZINYL)METHANE1THIONE
C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NC3=CC4=C(C=C3)OCO4
InChI=1SC18H17Cl2N3O2Sc19143213(1015(14)20)225723(8622)18(26)2112141617(912)25112416h14910H5811H2(H2126)
MFCD06028669
N(13benzodioxol5yl)4(34dichlorophenyl)piperazine1carbothioamide
ZINC000017088413
ZINC17088413
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