Vitas-M small molecule compound

N-[3-(benzylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide

Catalog ID
STK517085
SMILES Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)Nc1sc2c(c1C(=O)NCc1ccccc1)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 C28H26N2O4S MW 486.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O4S/c1-16-12-17(2)25-20(13-16)21(31)14-22(34-25)26(32)30-28-24(19-10-6-7-11-23(19)35-28)27(33)29-15-18-8-4-3-5-9-18/h3-5,8-9,12-14H,6-7,10-11,15H2,1-2H3,(H,29,33)(H,30,32)
InChIKey
DIWYDDPJVCLFGH-UHFFFAOYSA-N
Synonyms

CC1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CC=CC=C5)C
InChI=1SC28H26N2O4Sc1161217(2)2520(1316)21(31)1422(3425)26(32)302824(1910671123(19)3528)27(33)2915188435918h35891214H67101115H212H3(H2933)(H3032)
MFCD08549065
N(3(benzylcarbamoyl)4567tetrahydro1benzothiophen2yl)68dimethyl4oxo4Hchromene2carboxamide
N(3(benzylcarbamoyl)4567tetrahydro1benzothiophen2yl)68dimethyl4oxochromene2carboxamide
ZINC000009194694
ZINC09194694
ZINC9194694

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Available files

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