Vitas-M small molecule compound

N-(1-phenylethyl)-1-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]piperidine-4-carboxamide

Catalog ID
STK609998
SMILES O=C(C1CCN(CC1)C(=O)[C@H]1NCc2c(C1)cccc2)NC(c1ccccc1)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 C24H29N3O2 MW 391.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2/c1-17(18-7-3-2-4-8-18)26-23(28)19-11-13-27(14-12-19)24(29)22-15-20-9-5-6-10-21(20)16-25-22/h2-10,17,19,22,25H,11-16H2,1H3,(H,26,28)/t17?,22-/m0/s1
InChIKey
MGRDRDCNWXUTTI-UGNFMNBCSA-N
Synonyms

CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3CC4=CC=CC=C4CN3
InChI=1SC24H29N3O2c117(187324818)2623(28)19111327(141219)24(29)2215209561021(20)162522h21017192225H1116H21H3(H2628)t17?22m0s1
MFCD06779265
N(1phenylethyl)1((3S)1234tetrahydroisoquinolin3ylcarbonyl)piperidine4carboxamide
N(1phenylethyl)1((3S)1234tetrahydroisoquinoline3carbonyl)piperidine4carboxamide
N(1phenylethyl)1((S)1234tetrahydroisoquinoline3carbonyl)piperidine4carboxamidehydrochloride
O=C(C1CCN(CC1)C(=O)(C@H)1NCc2c(C1)cccc2)NC(c1ccccc1)C
O=C(C1CCN(CC1)C(=O)(C@H)1NCc2c(C1)cccc2)NC(c1ccccc1)CCl
ZINC000035378012
ZINC000035378014

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Available files

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