Vitas-M small molecule compound

N-[2-(furan-2-ylmethyl)cyclopentyl]-4-oxo-4-[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]butanamide

Catalog ID
STL525107
SMILES O=C(NC1CCCC1Cc1ccco1)CCC(=O)N1C[C@@H]2CC(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 C25H31N3O4 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O4/c29-23(26-21-6-1-4-18(21)13-20-5-3-11-32-20)9-10-24(30)27-14-17-12-19(16-27)22-7-2-8-25(31)28(22)15-17/h2-3,5,7-8,11,17-19,21H,1,4,6,9-10,12-16H2,(H,26,29)/t17-,18?,19?,21?/m1/s1
InChIKey
AUDRWADRXKYILE-PMRGXDQWSA-N
Synonyms

~(N)(2(furan2ylmethyl)cyclopentyl)4oxo4((9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)butanamide
16395181
InChI=1SC25H31N3O4c2923(262161418(21)132053113220)91024(30)2714171219(1627)2272825(31)28(22)1517h2357811171921H1469101216H2(H2629)t1718?19?21?m1s1
MFCD01543956
N(2(furan2ylmethyl)cyclopentyl)4oxo4((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)butanamide
N(2(furan2ylmethyl)cyclopentyl)4oxo4((5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)butanamide
O=C(NC1CCCC1Cc1ccco1)CCC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
ZINC000100740814
ZINC000252693105

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Available files

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