Vitas-M small molecule compound

(5E)-1-(butan-2-yl)-5-({[3-(morpholin-4-yl)propyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL037274
SMILES CCC(N1C(=NC(=O)/C(=C\NCCCN2CCOCC2)/C1=O)S)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 C16H26N4O3S MW 354.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N4O3S/c1-3-12(2)20-15(22)13(14(21)18-16(20)24)11-17-5-4-6-19-7-9-23-10-8-19/h11-12,17H,3-10H2,1-2H3,(H,18,21,24)/b13-11+
InChIKey
LTOAQTAJQIWMPI-ACCUITESSA-N
Synonyms

(5E)1(butan2yl)5(((3(morpholin4yl)propyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1BUTAN2YL5((3MORPHOLIN4YLPROPYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CCC(C)N1C(=O)C(=CNCCCN2CCOCC2)C(=O)NC1=S
CCC(N1C(=NC(=O)C(=CNCCCN2CCOCC2)C1=O)S)C
InChI=1SC16H26N4O3Sc1312(2)2015(22)13(14(21)1816(20)24)111754619792310819h111217H310H212H3(H182124)b1311+
MFCD04079697
ZINC000020329418
ZINC000020329423

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Available files

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