Vitas-M small molecule compound

[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}methanone

Catalog ID
STK453964
SMILES Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cc(nc2c1cccc2)c1ccc2c(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 C27H22ClN3O5S MW 536.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O5S/c28-19-6-8-20(9-7-19)37(33,34)31-13-11-30(12-14-31)27(32)22-16-24(29-23-4-2-1-3-21(22)23)18-5-10-25-26(15-18)36-17-35-25/h1-10,15-16H,11-14,17H2
InChIKey
SUVMZNZTILOHJS-UHFFFAOYSA-N
Synonyms

(2(13benzodioxol5yl)quinolin4yl)(4((4chlorophenyl)sulfonyl)piperazin1yl)methanone
(2(13benzodioxol5yl)quinolin4yl)(4(4chlorophenyl)sulfonylpiperazin1yl)methanone
2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL)4((4CHLOROPHENYL)SULFONYL)PIPERAZINYLKETONE
C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)S(=O)(=O)C6=CC=C(C=C6)Cl
InChI=1SC27H22ClN3O5Sc28196820(9719)37(3334)31131130(121431)27(32)221624(2923421321(22)23)185102526(1518)36173525h1101516H111417H2
MFCD04226641
ZINC000097945745
ZINC97945745

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Available files

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