Vitas-M small molecule compound

3-(2-{[(1-benzyl-5-oxopyrrolidin-3-yl)carbonyl]amino}ethyl)-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide

Catalog ID
STL567819
SMILES O=C(C1CC(=O)N(C1)Cc1ccccc1)NCCN1C(=O)C(C(=O)N)C2CC1(C)Oc1c2cccc1

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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 C27H30N4O5 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O5/c1-27-14-20(19-9-5-6-10-21(19)36-27)23(24(28)33)26(35)31(27)12-11-29-25(34)18-13-22(32)30(16-18)15-17-7-3-2-4-8-17/h2-10,18,20,23H,11-16H2,1H3,(H2,28,33)(H,29,34)
InChIKey
OLKYGNJICPGCLL-UHFFFAOYSA-N
Synonyms

10(2((1benzyl5oxopyrrolidine3carbonyl)amino)ethyl)9methyl11oxo8oxa10azatricyclo(731027)trideca246triene12carboxamide
127255291
3(2(((1benzyl5oxopyrrolidin3yl)carbonyl)amino)ethyl)2methyl4oxo3456tetrahydro2H26methano13benzoxazocine5carboxamide
3(2(1benzyl5oxopyrrolidine3carboxamido)ethyl)2methyl4oxo3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
InChI=1SC27H30N4O5c1271420(199561021(19)3627)23(24(28)33)26(35)31(27)12112925(34)181322(32)30(1618)15177324817h210182023H1116H21H3(H22833)(H2934)
MFCD32652995
ZINC000604419429
ZINC000604419432

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Available files

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