Vitas-M small molecule compound

(2E)-2-{[4-(cycloheptylamino)-4-oxobutanoyl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylic acid

Catalog ID
STL318909
SMILES O=C(NC1CCCCCC1)CCC(=O)/N=c\1/sc(c([nH]1)C(=O)O)C(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 C18H27N3O4S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O4S/c1-11(2)16-15(17(24)25)21-18(26-16)20-14(23)10-9-13(22)19-12-7-5-3-4-6-8-12/h11-12H,3-10H2,1-2H3,(H,19,22)(H,24,25)(H,20,21,23)
InChIKey
OMJGETWECGKJKR-UHFFFAOYSA-N
Synonyms
1435982-71-0
(2E)2((4(cycloheptylamino)4oxobutanoyl)imino)5(propan2yl)23dihydro13thiazole4carboxylicacid
1435982710
2((4(cycloheptylamino)4oxobutanoyl)amino)5propan2yl13thiazole4carboxylicacid
CC(C)C1=C(N=C(S1)NC(=O)CCC(=O)NC2CCCCCC2)C(=O)O
InChI=1SC18H27N3O4Sc111(2)1615(17(24)25)2118(2616)2014(23)10913(22)191275346812h1112H310H212H3(H1922)(H2425)(H202123)
MFCD28031559
O=C(NC1CCCCCC1)CCC(=O)N=c1sc(c((nH)1)C(=O)O)C(C)C
ZINC000095479673
ZINC95479673

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Available files

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