Vitas-M small molecule compound

1-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)-4-(1H-tetrazol-1-yl)butan-1-one

Catalog ID
STL566460
SMILES O=C(N1CCc2c(C1)[nH]c1c2cccc1)CCCn1cnnn1

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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 C16H18N6O MW 310.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O/c23-16(6-3-8-22-11-17-19-20-22)21-9-7-13-12-4-1-2-5-14(12)18-15(13)10-21/h1-2,4-5,11,18H,3,6-10H2
InChIKey
DOKKQMKHQWAUDX-UHFFFAOYSA-N
Synonyms

1(1349tetrahydro2Hbetacarbolin2yl)4(1Htetrazol1yl)butan1one
1(1349tetrahydropyrido(34b)indol2yl)4(tetrazol1yl)butan1one
1(34dihydro1Hpyrido(34b)indol2(9H)yl)4(1Htetrazol1yl)butan1one
125432985
InChI=1SC16H18N6Oc2316(638221117192022)21971312412514(12)1815(13)1021h12451118H3610H2
MFCD32262560
O=C(N1CCc2c(C1)(nH)c1c2cccc1)CCCn1cnnn1
ZINC000524734425

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.