Vitas-M small molecule compound

N-{[(2S)-3-oxo-2-(propan-2-yl)-3,4-dihydroquinoxalin-1(2H)-yl]carbonyl}-L-phenylalanyl-D-methionine

Catalog ID
STL008052
SMILES CSCC[C@H](C(=O)O)NC(=O)[C@@H](NC(=O)N1[C@@H](C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1

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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 C26H32N4O5S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O5S/c1-16(2)22-24(32)27-18-11-7-8-12-21(18)30(22)26(35)29-20(15-17-9-5-4-6-10-17)23(31)28-19(25(33)34)13-14-36-3/h4-12,16,19-20,22H,13-15H2,1-3H3,(H,27,32)(H,28,31)(H,29,35)(H,33,34)/t19-,20+,22+/m1/s1
InChIKey
BTVGCEKXCBYAQS-URVUXULASA-N
Synonyms
956996-64-8
(2R)4methylsulfanyl2(((2S)2(((2S)3oxo2propan2yl24dihydroquinoxaline1carbonyl)amino)3phenylpropanoyl)amino)butanoicacid
(S)2((S)2((S)2isopropyl3oxo1234tetrahydroquinoxaline1carboxamido)3phenylpropanamido)4(methylthio)butanoicacid
956996648
CC(C)C1C(=O)NC2=CC=CC=C2N1C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CCSC)C(=O)O
CSCC(C@@H)(C(=O)O)NC(=O)(C@@H)(NC(=O)N1(C@@H)(C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1
CSCC(C@H)(C(=O)O)NC(=O)(C@@H)(NC(=O)N1(C@@H)(C(C)C)C(=O)Nc2c1cccc2)Cc1ccccc1
InChI=1SC26H32N4O5Sc116(2)2224(32)271811781221(18)30(22)26(35)2920(151795461017)23(31)2819(25(33)34)1314363h41216192022H1315H213H3(H2732)(H2831)(H2935)(H3334)t1920+22+m1s1
MFCD07637928
N(((2S)3OXO2(PROPAN2YL)34DIHYDROQUINOXALIN1(2H)YL)CARBONYL)LPHENYLALANYLDMETHIONINE
ZINC000008876854
ZINC8876854

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Available files

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