Vitas-M small molecule compound

N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide

Catalog ID
STL261679
SMILES COc1ccc2c(c1)c(CCN1CC(CC1=O)C(=O)Nc1nnc(s1)Cc1ccccc1)c[nH]2

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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 C25H25N5O3S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O3S/c1-33-19-7-8-21-20(13-19)17(14-26-21)9-10-30-15-18(12-23(30)31)24(32)27-25-29-28-22(34-25)11-16-5-3-2-4-6-16/h2-8,13-14,18,26H,9-12,15H2,1H3,(H,27,29,32)
InChIKey
ZYUNLOKCWMJZHX-UHFFFAOYSA-N
Synonyms
945211-24-5
(1(2(5METHOXYINDOL3YL)ETHYL)5OXOPYRROLIDIN3YL)N(5BENZYL(134THIADIAZOL2YL))CARBOXAMIDE
945211245
COC1=CC2=C(C=C1)NC=C2CCN3CC(CC3=O)C(=O)NC4=NN=C(S4)CC5=CC=CC=C5
COc1ccc2c(c1)c(CCN1CC(CC1=O)C(=O)Nc1nnc(s1)Cc1ccccc1)c(nH)2
InChI=1SC25H25N5O3Sc13319782120(1319)17(142621)910301518(1223(30)31)24(32)2725292822(3425)11165324616h2813141826H91215H21H3(H272932)
MFCD09443943
N(5benzyl134thiadiazol2yl)1(2(5methoxy1Hindol3yl)ethyl)5oxopyrrolidine3carboxamide
ZINC000020259452
ZINC000020259454

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Available files

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