Vitas-M small molecule compound

(5Z)-1-(butan-2-yl)-5-{[(4-ethoxyphenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STL041107
SMILES CCOc1ccc(cc1)N/C=C\1/C(=O)N=C(N(C1=O)C(CC)C)S

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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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-4-11(3)20-16(22)14(15(21)19-17(20)24)10-18-12-6-8-13(9-7-12)23-5-2/h6-11,18H,4-5H2,1-3H3,(H,19,21,24)/b14-10-
InChIKey
VBMPSMMXPIZFGM-UVTDQMKNSA-N
Synonyms

(5Z)1(butan2yl)5(((4ethoxyphenyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1BUTAN2YL5((4ETHOXYANILINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CCC(C)N1C(=O)C(=CNC2=CC=C(C=C2)OCC)C(=O)NC1=S
CCOc1ccc(cc1)NC=C1C(=O)N=C(N(C1=O)C(CC)C)S
InChI=1SC17H21N3O3Sc1411(3)2016(22)14(15(21)1917(20)24)1018126813(9712)2352h61118H45H213H3(H192124)b1410
MFCD05733627
ZINC000009359396
ZINC000009477195

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Available files

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