Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-3-{2-[(4-chlorophenyl)sulfanyl]phenyl}thiourea
Catalog ID
STK456739
SMILES S=C(Nc1ccccc1Sc1ccc(cc1)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 C20H15ClN2O2S2 MW 414.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O2S2/c21-13-5-8-15(9-6-13)27-19-4-2-1-3-16(19)23-20(26)22-14-7-10-17-18(11-14)25-12-24-17/h1-11H,12H2,(H2,22,23,26)InChIKey
WXDKDIDQXJHXRQ-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLAMINO)((2(4CHLOROPHENYLTHIO)PHENYL)AMINO)METHANE1THIONE
1(13benzodioxol5yl)3(2((4chlorophenyl)sulfanyl)phenyl)thiourea
1(13BENZODIOXOL5YL)3(2(4CHLOROPHENYL)SULFANYLPHENYL)THIOUREA
C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl
InChI=1SC20H15ClN2O2S2c21135815(9613)2719421316(19)2320(26)22147101718(1114)25122417h111H12H2(H2222326)
MFCD05140880
ZINC000002856163
ZINC02856163
ZINC2856163
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