Vitas-M small molecule compound

Catalog ID
STK575664
SMILES CCC([C@@H](C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)[C@H]1NCc2c(C1)cccc2)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 C24H29N3O4 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O4/c1-3-15(2)22(24(29)26-18-8-9-20-21(13-18)31-11-10-30-20)27-23(28)19-12-16-6-4-5-7-17(16)14-25-19/h4-9,13,15,19,22,25H,3,10-12,14H2,1-2H3,(H,26,29)(H,27,28)/t15?,19-,22-/m0/s1
InChIKey
OKWVSEAJCQWYPN-WWIHDFJWSA-N
Synonyms

(3S)N((2S)1(23dihydro14benzodioxin6ylamino)3methyl1oxopentan2yl)1234tetrahydroisoquinoline3carboxamide
(S)N((2S3R)1((23dihydrobenzo(b)(14)dioxin6yl)amino)3methyl1oxopentan2yl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CCC((C@@H)(C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)(C@H)1NCc2c(C1)cccc2)C
CCC((C@@H)(C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)(C@H)1NCc2c(C1)cccc2)CCl
CCC(C)C(C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3CC4=CC=CC=C4CN3
InChI=1SC24H29N3O4c1315(2)22(24(29)2618892021(1318)3111103020)2723(28)191216645717(16)142519h491315192225H3101214H212H3(H2629)(H2728)t15?1922m0s1
MFCD06773339
ZINC000035349297
ZINC000035485571

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Available files

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