Vitas-M small molecule compound

8-butoxy-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

Catalog ID
STK532054
SMILES CCCCOc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C

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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 C20H25N3OS MW 355.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3OS/c1-4-5-10-24-19-18-17(21-11-22-19)15-13-8-6-7-9-14(13)16(12(2)3)23-20(15)25-18/h11-12H,4-10H2,1-3H3
InChIKey
VJQCUCMYZKGKQQ-UHFFFAOYSA-N
Synonyms

8butoxy5(propan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8butoxy5isopropyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCCOC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C(C)C
InChI=1SC20H25N3OSc1451024191817(21112219)1513867914(13)16(12(2)3)2320(15)2518h1112H410H213H3
MFCD02242007
ZINC000002299357
ZINC02299357
ZINC2299357

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Available files

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