Vitas-M small molecule compound

5-[1-(3-chloro-4-methylphenyl)-1H-tetrazol-5-yl]-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline

Catalog ID
STL537289
SMILES COc1c2c(CCN(C2c2nnnn2c2ccc(c(c2)Cl)C)C)cc2c1OCO2

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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 C20H20ClN5O3 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O3/c1-11-4-5-13(9-14(11)21)26-20(22-23-24-26)17-16-12(6-7-25(17)2)8-15-18(19(16)27-3)29-10-28-15/h4-5,8-9,17H,6-7,10H2,1-3H3
InChIKey
HFZLLQUFBYPWDW-UHFFFAOYSA-N
Synonyms
859140-79-7
4266892
5(1(3chloro4methylphenyl)1Htetrazol5yl)4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinoline
5(1(3chloro4methylphenyl)tetrazol5yl)4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinoline
5(1(3CHLORO4METHYLPHENYL)TETRAZOL5YL)4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLINE
859140797
InChI=1SC20H20ClN5O3c1114513(914(11)21)2620(22232426)171612(6725(17)2)81518(19(16)273)29102815h458917H6710H213H3
MFCD05671478
ZINC000020412807
ZINC000020412810

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Available files

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