Vitas-M small molecule compound

(2Z)-2-{4-[2-(4-cyclohexylphenoxy)ethoxy]-3-methoxybenzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one

Catalog ID
STL416933
SMILES COc1cc(ccc1OCCOc1ccc(cc1)C1CCCCC1)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

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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 C31H30N2O4S MW 526.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O4S/c1-35-28-19-21(20-29-30(34)33-26-10-6-5-9-25(26)32-31(33)38-29)11-16-27(28)37-18-17-36-24-14-12-23(13-15-24)22-7-3-2-4-8-22/h5-6,9-16,19-20,22H,2-4,7-8,17-18H2,1H3/b29-20-
InChIKey
KNJDSEDKTSPLST-BRPDVVIDSA-N
Synonyms

(2Z)2((4(2(4CYCLOHEXYLPHENOXY)ETHOXY)3METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)2(4(2(4cyclohexylphenoxy)ethoxy)3methoxybenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
2((4(2(4CYCLOHEXYLPHENOXY)ETHOXY)3METHOXYPHENYL)METHYLENE)13THIAZOLIDINO(32A)BENZIMIDAZOL3ONE
COC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCCOC5=CC=C(C=C5)C6CCCCC6
COc1cc(ccc1OCCOc1ccc(cc1)C1CCCCC1)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC31H30N2O4Sc135281921(202930(34)33261065925(26)3231(33)3829)111627(28)3718173624141223(131524)227324822h56916192022H24781718H21H3b2920
MFCD02122229
ZINC000008741980
ZINC08741980
ZINC8741980

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Available files

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