Vitas-M small molecule compound
4-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methylbenzoate
Catalog ID
STL406447
SMILES N=C1NC(=O)/C(=C/c2ccc(cc2)OC(=O)c2cccc(c2)C)/S1
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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(19)24-15/h2-10H,1H3,(H2,19,20,21)/b15-10-InChIKey
BFEOXTGOOBDQKX-GDNBJRDFSA-NSynonyms
(4((Z)(2amino4oxo13thiazol5ylidene)methyl)phenyl)3methylbenzoate
4((Z)(2imino4oxo13thiazolidin5ylidene)methyl)phenyl3methylbenzoate
CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C=C3C(=O)N=C(S3)N
InChI=1SC18H14N2O3Sc11132413(911)17(22)23147512(6814)101516(21)2018(19)2415h210H1H3(H2192021)b1510
MFCD02900367
N=C1NC(=O)C(=Cc2ccc(cc2)OC(=O)c2cccc(c2)C)S1
ZINC000033644987
ZINC33644987
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