Vitas-M small molecule compound

6-amino-1,3-dimethyl-5-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetyl}pyrimidine-2,4(1H,3H)-dione

Catalog ID
STL539676
SMILES O=C(c1c(N)n(C)c(=O)n(c1=O)C)CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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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 C19H23N5O4 MW 385.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5O4/c1-21-17(20)16(18(27)22(2)19(21)28)14(25)10-23-7-11-6-12(9-23)13-4-3-5-15(26)24(13)8-11/h3-5,11-12H,6-10,20H2,1-2H3/t11-,12+/m0/s1
InChIKey
VUVBECACOAHFAU-NWDGAFQWSA-N
Synonyms

6amino13dimethyl5(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)acetyl)pyrimidine24(1H3H)dione
6amino13dimethyl5(2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)acetyl)pyrimidine24(1H3H)dione
InChI=1SC19H23N5O4c12117(20)16(18(27)22(2)19(21)28)14(25)1023711612(923)1343515(26)24(13)811h351112H61020H212H3t1112+m0s1
O=C(c1c(N)n(C)c(=O)n(c1=O)C)CN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000085879860

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Available files

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