Vitas-M small molecule compound

3-[(3S)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-(6-methylheptan-2-yl)propanamide

Catalog ID
STK936357
SMILES CC(CCCC(NC(=O)CC[C@@H]1NC(=O)c2c(N=C1O)cccc2)C)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 C20H29N3O3 MW 359.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O3/c1-13(2)7-6-8-14(3)21-18(24)12-11-17-20(26)22-16-10-5-4-9-15(16)19(25)23-17/h4-5,9-10,13-14,17H,6-8,11-12H2,1-3H3,(H,21,24)(H,22,26)(H,23,25)/t14?,17-/m0/s1
InChIKey
YONCBUUKYXPEQP-JRZJBTRGSA-N
Synonyms
1246037-83-1
1246037831
3((3S)25dioxo34dihydro1H14benzodiazepin3yl)N(6methylheptan2yl)propanamide
3((3S)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(6methylheptan2yl)propanamide
CC(C)CCCC(C)NC(=O)CCC1C(=O)NC2=CC=CC=C2C(=O)N1
CC(CCCC(NC(=O)CC(C@@H)1NC(=O)c2c(N=C1O)cccc2)C)C
InChI=1SC20H29N3O3c113(2)76814(3)2118(24)12111720(26)22161054915(16)19(25)2317h45910131417H681112H213H3(H2124)(H2226)(H2325)t14?17m0s1
MFCD18178331
ZINC000044901817
ZINC000044901820

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Available files

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