Vitas-M small molecule compound
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(pyrrolidin-1-ylsulfonyl)phenyl]thiourea
Catalog ID
STK461556
SMILES COc1cc(CCNC(=S)Nc2ccc(cc2)S(=O)(=O)N2CCCC2)ccc1OC
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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 C21H27N3O4S2 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O4S2/c1-27-19-10-5-16(15-20(19)28-2)11-12-22-21(29)23-17-6-8-18(9-7-17)30(25,26)24-13-3-4-14-24/h5-10,15H,3-4,11-14H2,1-2H3,(H2,22,23,29)InChIKey
QJIOGFIWGRFQOI-UHFFFAOYSA-NSynonyms
((4((((2(34DIMETHOXYPHENYL)ETHYL)AMINO)THIOXOMETHYL)AMINO)PHENYL)SULFONYL)PYRROLIDINE
1(2(34dimethoxyphenyl)ethyl)3(4(pyrrolidin1ylsulfonyl)phenyl)thiourea
1(2(34DIMETHOXYPHENYL)ETHYL)3(4PYRROLIDIN1YLSULFONYLPHENYL)THIOUREA
COC1=C(C=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)OC
InChI=1SC21H27N3O4S2c1271910516(1520(19)282)11122221(29)23176818(9717)30(2526)2413341424h51015H341114H212H3(H2222329)
MFCD05058499
ZINC000016361067
ZINC16361067
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