Vitas-M small molecule compound

4-[(4,6-dimethylpyrimidin-2-yl)amino]-1-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)butan-1-one

Catalog ID
STL472835
SMILES Cc1cc(C)nc(n1)NCCCC(=O)N1CCc2c(C1)[nH]c1c2cccc1

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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 C21H25N5O MW 363.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O/c1-14-12-15(2)24-21(23-14)22-10-5-8-20(27)26-11-9-17-16-6-3-4-7-18(16)25-19(17)13-26/h3-4,6-7,12,25H,5,8-11,13H2,1-2H3,(H,22,23,24)
InChIKey
IESAVCKHIBYQHU-UHFFFAOYSA-N
Synonyms
1435900-74-5
1(34dihydro1Hpyrido(34b)indol2(9H)yl)4((46dimethylpyrimidin2yl)amino)butan1one
1435900745
4((46dimethylpyrimidin2yl)amino)1(1349tetrahydro2Hbetacarbolin2yl)butan1one
4((46dimethylpyrimidin2yl)amino)1(1349tetrahydropyrido(34b)indol2yl)butan1one
CC1=CC(=NC(=N1)NCCCC(=O)N2CCC3=C(C2)NC4=CC=CC=C34)C
Cc1cc(C)nc(n1)NCCCC(=O)N1CCc2c(C1)(nH)c1c2cccc1
InChI=1SC21H25N5Oc1141215(2)2421(2314)22105820(27)261191716634718(16)2519(17)1326h34671225H581113H212H3(H222324)
MFCD23136790
ZINC000085879881
ZINC85879881

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Available files

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