Vitas-M small molecule compound

3-(4-chlorophenyl)-1-[2-(4-chlorophenyl)-2-oxoethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK555402
SMILES Clc1ccc(cc1)C(=O)Cn1c2sc3c(c2c(=O)n(c1=O)c1ccc(cc1)Cl)CCCC3

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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 C24H18Cl2N2O3S MW 485.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18Cl2N2O3S/c25-15-7-5-14(6-8-15)19(29)13-27-23-21(18-3-1-2-4-20(18)32-23)22(30)28(24(27)31)17-11-9-16(26)10-12-17/h5-12H,1-4,13H2
InChIKey
NEJKFTCBZIQHKQ-UHFFFAOYSA-N
Synonyms
840518-78-7
3(4chlorophenyl)1(2(4chlorophenyl)2oxoethyl)5678tetrahydro(1)benzothieno(23d)pyrimidine24(1H3H)dione
3(4chlorophenyl)1(2(4chlorophenyl)2oxoethyl)5678tetrahydro(1)benzothiolo(23d)pyrimidine24dione
3(4chlorophenyl)1(2(4chlorophenyl)2oxoethyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidine24(1H3H)dione
840518787
C1CCC2=C(C1)C3=C(S2)N(C(=O)N(C3=O)C4=CC=C(C=C4)Cl)CC(=O)C5=CC=C(C=C5)Cl
InChI=1SC24H18Cl2N2O3Sc25157514(6815)19(29)13272321(18312420(18)3223)22(30)28(24(27)31)1711916(26)101217h512H1413H2
MFCD04010964
ZINC000002335684
ZINC02335684
ZINC2335684

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.