Vitas-M small molecule compound
{[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)carbonyl]amino}(phenyl)acetic acid
Catalog ID
STL373124
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)NC(c1ccccc1)C(=O)O
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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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c24-17-8-4-7-16-15-9-13(11-23(16)17)10-22(12-15)20(27)21-18(19(25)26)14-5-2-1-3-6-14/h1-8,13,15,18H,9-12H2,(H,21,27)(H,25,26)InChIKey
NYSPQRRENZKGJJ-UHFFFAOYSA-NSynonyms
1796916-14-7(((8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonyl)amino)(phenyl)aceticacid
(S)2((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carboxamido)2phenylaceticacid
1796916147
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)NC(C4=CC=CC=C4)C(=O)O
InChI=1SC20H21N3O4c24178471615913(1123(16)17)1022(1215)20(27)2118(19(25)26)145213614h18131518H912H2(H2127)(H2526)
MFCD28143006
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)N(C@@H)(c1ccccc1)C(=O)O
ZINC000085863661
ZINC000098063893
Check stock
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