Vitas-M small molecule compound

2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(5-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}-1,3-benzoxazol-2-yl)phenyl]acetamide

Catalog ID
STK112327
SMILES O=C(Nc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=O)CSc1oc2c(n1)cccc2)CSc1oc2c(n1)cccc2

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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 C31H21N5O5S2 MW 607.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21N5O5S2/c37-27(16-42-30-35-21-5-1-3-7-24(21)40-30)32-19-11-9-18(10-12-19)29-34-23-15-20(13-14-26(23)39-29)33-28(38)17-43-31-36-22-6-2-4-8-25(22)41-31/h1-15H,16-17H2,(H,32,37)(H,33,38)
InChIKey
LVQRJNDBASFPMO-UHFFFAOYSA-N
Synonyms
312281-03-1
2(13BENZOXAZOL2YLSULFANYL)N(4(5(((13BENZOXAZOL2YLSULFANYL)ACETYL)AMINO)13BENZOXAZOL2YL)PHENYL)ACETAMIDE
2(13BENZOXAZOL2YLSULFANYL)N(4(5((2(13BENZOXAZOL2YLSULFANYL)ACETYL)AMINO)13BENZOXAZOL2YL)PHENYL)ACETAMIDE
2BENZOXAZOL2YLTHION(2(4(2BENZOXAZOL2YLTHIOACETYLAMINO)PHENYL)BENZOXAZOL5YL)ACETAMIDE
312281031
C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=CC=C(C=C3)C4=NC5=C(O4)C=CC(=C5)NC(=O)CSC6=NC7=CC=CC=C7O6
InChI=1SC31H21N5O5S2c3727(1642303521513724(21)4030)321911918(101219)2934231520(131426(23)3929)3328(38)1743313622624825(22)4131h115H1617H2(H3237)(H3338)
MFCD01305054
ZINC000098002642
ZINC98002642

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Available files

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