Vitas-M small molecule compound

Catalog ID
STK575697
SMILES CCC([C@@H](C(=O)NCc1ccc(cc1)F)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 C26H30FN3O3S MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30FN3O3S/c1-5-15(2)20(22(31)28-14-16-10-12-17(27)13-11-16)29-23(32)21-26(3,4)34-25-19-9-7-6-8-18(19)24(33)30(21)25/h6-13,15,20-21,25H,5,14H2,1-4H3,(H,28,31)(H,29,32)/t15?,20-,21+,25?/m0/s1
InChIKey
UNILGZQMDMOAJV-OSTBROBVSA-N
Synonyms
1014044-13-3
(3R)N((2S)1((4fluorophenyl)methylamino)3methyl1oxopentan2yl)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S3R)1((4fluorobenzyl)amino)3methyl1oxopentan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1014044133
CCC((C@@H)(C(=O)NCc1ccc(cc1)F)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
CCC(C)C(C(=O)NCC1=CC=C(C=C1)F)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC26H30FN3O3Sc1515(2)20(22(31)281416101217(27)131116)2923(32)2126(34)342519976818(19)24(33)30(21)25h61315202125H514H214H3(H2831)(H2932)t15?2021+25?m0s1
MFCD08284424
ZINC000013576745
ZINC000013576753

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Available files

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