Vitas-M small molecule compound

2-{[(E)-anthracen-9-ylmethylidene]amino}-N-benzyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STL506441
SMILES O=C(c1c(/N=C/c2c3ccccc3cc3c2cccc3)sc2c1CCCC2)NCc1ccccc1

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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 C31H26N2OS MW 474.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2OS/c34-30(32-19-21-10-2-1-3-11-21)29-26-16-8-9-17-28(26)35-31(29)33-20-27-24-14-6-4-12-22(24)18-23-13-5-7-15-25(23)27/h1-7,10-15,18,20H,8-9,16-17,19H2,(H,32,34)/b33-20+
InChIKey
QFXZDSZVTUPFIP-FMFFXOCNSA-N
Synonyms

2(((E)anthracen9ylmethylidene)amino)Nbenzyl4567tetrahydro1benzothiophene3carboxamide
2((~(E))anthracen9ylmethylideneamino)~(N)benzyl4567tetrahydro1benzothiophene3carboxamide
9628817
InChI=1SC31H26N2OSc3430(321921102131121)292616891728(26)3531(29)3320272414641222(24)182313571525(23)27h1710151820H89161719H2(H3234)b3320+
MFCD05149858
ZINC000016479968

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.