Vitas-M small molecule compound
N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-alanyl-beta-alanine
Catalog ID
STK583444
SMILES OC(=O)CCNC(=O)[C@@H](NC(=O)c1cc2c(n1C)ccc(c2)Cl)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 C16H18ClN3O4 MW 351.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN3O4/c1-9(15(23)18-6-5-14(21)22)19-16(24)13-8-10-7-11(17)3-4-12(10)20(13)2/h3-4,7-9H,5-6H2,1-2H3,(H,18,23)(H,19,24)(H,21,22)/t9-/m0/s1InChIKey
SKQVJFZIZXSDDD-VIFPVBQESA-NSynonyms
1173683-46-9(S)3(2(5chloro1methyl1Hindole2carboxamido)propanamido)propanoicacid
1173683469
3(((2S)2((5chloro1methylindole2carbonyl)amino)propanoyl)amino)propanoicacid
CC(C(=O)NCCC(=O)O)NC(=O)C1=CC2=C(N1C)C=CC(=C2)Cl
InChI=1SC16H18ClN3O4c19(15(23)186514(21)22)1916(24)13810711(17)3412(10)20(13)2h3479H56H212H3(H1823)(H1924)(H2122)t9m0s1
MFCD06778659
N((5chloro1methyl1Hindol2yl)carbonyl)Lalanylbetaalanine
OC(=O)CCNC(=O)(C@@H)(NC(=O)c1cc2c(n1C)ccc(c2)Cl)C
ZINC000005302804
ZINC5302804
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