Vitas-M small molecule compound
4-[(E)-(5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]phenyl 3-methylbenzoate
Catalog ID
STK065401
SMILES S=C1NC(=O)/C(=C\c2ccc(cc2)OC(=O)c2cccc(c2)C)/N1
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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 C18H14N2O3S MW 338.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O3S/c1-11-3-2-4-13(9-11)17(22)23-14-7-5-12(6-8-14)10-15-16(21)20-18(24)19-15/h2-10H,1H3,(H2,19,20,21,24)/b15-10+InChIKey
JYOPSSTWRQPDAT-XNTDXEJSSA-NSynonyms
(4((E)(5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENYL)3METHYLBENZOATE
4((E)(5OXO2THIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C=C3C(=O)NC(=S)N3
InChI=1SC18H14N2O3Sc11132413(911)17(22)23147512(6814)101516(21)2018(24)1915h210H1H3(H219202124)b1510+
MFCD00292478
S=C1NC(=O)C(=Cc2ccc(cc2)OC(=O)c2cccc(c2)C)N1
STK065401
ZINC000005201290
ZINC05201290
ZINC5201290
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