Vitas-M small molecule compound

methyl 1-{N-[(5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)carbonyl]-L-methionyl}piperidine-4-carboxylate

Catalog ID
STL546974
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)OC)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

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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 C25H31N3O7S MW 517.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O7S/c1-4-27-13-17(22(29)16-11-20-21(12-19(16)27)35-14-34-20)23(30)26-18(7-10-36-3)24(31)28-8-5-15(6-9-28)25(32)33-2/h11-13,15,18H,4-10,14H2,1-3H3,(H,26,30)/t18-/m0/s1
InChIKey
FAYRULNZHRRHFL-SFHVURJKSA-N
Synonyms
957024-16-7
(S)methyl1(2(5ethyl8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamido)4(methylthio)butanoyl)piperidine4carboxylate
16408321
957024167
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)OC)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC25H31N3O7Sc14271317(22(29)16112021(1219(16)27)35143420)23(30)2618(710363)24(31)288515(6928)25(32)332h11131518H41014H213H3(H2630)t18m0s1
methyl1((2~(S))2((5ethyl8oxo(13)dioxolo(45g)quinoline7carbonyl)amino)4methylsulfanylbutanoyl)piperidine4carboxylate
methyl1(N((5ethyl8oxo58dihydro(13)dioxolo(45g)quinolin7yl)carbonyl)Lmethionyl)piperidine4carboxylate
ZINC000012895838
ZINC12895838

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Available files

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