Vitas-M small molecule compound

2-(2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide

Catalog ID
STL450758
SMILES Cc1ccc(cc1)OCCSc1nc2c(n1CC(=O)N(C(C)C)C(C)C)cccc2

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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 C24H31N3O2S MW 425.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O2S/c1-17(2)27(18(3)4)23(28)16-26-22-9-7-6-8-21(22)25-24(26)30-15-14-29-20-12-10-19(5)11-13-20/h6-13,17-18H,14-16H2,1-5H3
InChIKey
UPQVSBKHPVWVKE-UHFFFAOYSA-N
Synonyms

2(2((2(4methylphenoxy)ethyl)sulfanyl)1Hbenzimidazol1yl)NNdi(propan2yl)acetamide
2(2(2(4methylphenoxy)ethylsulfanyl)benzimidazol1yl)NNdi(propan2yl)acetamide
CC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)N(C(C)C)C(C)C
InChI=1SC24H31N3O2Sc117(2)27(18(3)4)23(28)162622976821(22)2524(26)3015142920121019(5)111320h6131718H1416H215H3
MFCD10044604
NNBIS(METHYLETHYL)2(2(2(4METHYLPHENOXY)ETHYLTHIO)BENZIMIDAZOLYL)ACETAMIDE
ZINC000012062330
ZINC12062330

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Available files

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