Vitas-M small molecule compound

2-ethoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate

Catalog ID
STK070879
SMILES CCOc1cc(ccc1OC(=O)c1ccc(cc1)C)/C=C\1/SC(=S)N(C1=O)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 C21H19NO4S2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO4S2/c1-4-25-17-11-14(12-18-19(23)22(3)21(27)28-18)7-10-16(17)26-20(24)15-8-5-13(2)6-9-15/h5-12H,4H2,1-3H3/b18-12+
InChIKey
CYSXPMJCECXCDZ-LDADJPATSA-N
Synonyms

(2ethoxy4((E)(3methyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)4methylbenzoate
2ETHOXY4((E)(3METHYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL4METHYLBENZOATE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C)OC(=O)C3=CC=C(C=C3)C
CCOc1cc(ccc1OC(=O)c1ccc(cc1)C)C=C1SC(=S)N(C1=O)C
InChI=1SC21H19NO4S2c1425171114(121819(23)22(3)21(27)2818)71016(17)2620(24)158513(2)6915h512H4H213H3b1812+
MFCD01233962
STK070879
ZINC000000975348
ZINC00975348
ZINC975348

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Available files

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