Vitas-M small molecule compound
(5E)-5-{[(2-aminocyclohexyl)amino]methylidene}-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK563891
SMILES NC1CCCCC1N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1)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 C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c18-13-8-4-5-9-14(13)19-10-12-15(22)20-17(24)21(16(12)23)11-6-2-1-3-7-11/h1-3,6-7,10,13-14,19H,4-5,8-9,18H2,(H,20,22,24)/b12-10+InChIKey
VMNVYGXDZFTPSS-ZRDIBKRKSA-NSynonyms
(5E)5(((2aminocyclohexyl)amino)methylidene)1phenyl2sulfanylidene13diazinane46dione
(5E)5(((2aminocyclohexyl)amino)methylidene)1phenyl2sulfanylpyrimidine46(1H5H)dione
C1CCC(C(C1)N)NC=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3
InChI=1SC17H20N4O2Sc1813845914(13)19101215(22)2017(24)21(16(12)23)116213711h136710131419H458918H2(H202224)b1210+
MFCD04077870
NC1CCCCC1NC=C1C(=O)N=C(N(C1=O)c1ccccc1)S
ZINC000020291874
ZINC000020291883
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