Vitas-M small molecule compound

(5Z)-3-cyclohexyl-5-[(5Z)-3-cyclohexyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK675778
SMILES COc1ccc2c(c1)n(C)/c(=c\1/s/c(=C/3\SC(=S)N(C3=O)C3CCCCC3)/n(c1=O)C1CCCCC1)/s2

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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 C27H31N3O3S4 MW 573.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O3S4/c1-28-19-15-18(33-2)13-14-20(19)35-25(28)21-23(31)29(16-9-5-3-6-10-16)26(36-21)22-24(32)30(27(34)37-22)17-11-7-4-8-12-17/h13-17H,3-12H2,1-2H3/b25-21-,26-22-
InChIKey
HCRLSXWCHMUUFW-ORFRIDJFSA-N
Synonyms

(2Z5Z)3CYCLOHEXYL2(3CYCLOHEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)5(5METHOXY3METHYL13BENZOTHIAZOL2YLIDENE)13THIAZOLIDIN4ONE
(5Z)3CYCLOHEXYL5((5Z)3CYCLOHEXYL5(5METHOXY3METHYL13BENZOTHIAZOL2(3H)YLIDENE)4OXO13THIAZOLIDIN2YLIDENE)2THIOXO13THIAZOLIDIN4ONE
5(5METHOXY3METHYL13BENZOTHIAZOL2(3H)YLIDENE)2THIOXO25BIS(3CYCLOHEXYL4OXO13THIAZOLIDIN2YLIDENE)
CN1C2=C(C=CC(=C2)OC)SC1=C3C(=O)N(C(=C4C(=O)N(C(=S)S4)C5CCCCC5)S3)C6CCCCC6
COc1ccc2c(c1)n(C)c(=c1sc(=C3SC(=S)N(C3=O)C3CCCCC3)n(c1=O)C1CCCCC1)s2
InChI=1SC27H31N3O3S4c128191518(332)131420(19)3525(28)2123(31)29(1695361016)26(3621)2224(32)30(27(34)3722)17117481217h1317H312H212H3b25212622
MFCD01820576
ZINC000100082789
ZINC100082789

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Available files

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