Vitas-M small molecule compound

Catalog ID
STK579812
SMILES CCC([C@@H](C(=O)NC1CCCCC1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

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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 C25H35N3O3S MW 457.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35N3O3S/c1-5-15(2)19(21(29)26-16-11-7-6-8-12-16)27-22(30)20-25(3,4)32-24-18-14-10-9-13-17(18)23(31)28(20)24/h9-10,13-16,19-20,24H,5-8,11-12H2,1-4H3,(H,26,29)(H,27,30)/t15?,19-,20+,24?/m0/s1
InChIKey
WBSYZTWNFIGSSA-JMJCCKCPSA-N
Synonyms
1014084-88-8
(3R)N((2S)1(cyclohexylamino)3methyl1oxopentan2yl)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S3R)1(cyclohexylamino)3methyl1oxopentan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1014084888
CCC((C@@H)(C(=O)NC1CCCCC1)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
CCC(C)C(C(=O)NC1CCCCC1)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC25H35N3O3Sc1515(2)19(21(29)2616117681216)2722(30)2025(34)322418141091317(18)23(31)28(20)24h9101316192024H581112H214H3(H2629)(H2730)t15?1920+24?m0s1
MFCD08284525
ZINC000009129476
ZINC000013591545

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Available files

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