Vitas-M small molecule compound

4-oxo-N-{3-[(pyridin-3-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4H-chromene-2-carboxamide

Catalog ID
STK853153
SMILES O=C(c1c(sc2c1CCCC2)NC(=O)c1cc(=O)c2c(o1)cccc2)NCc1cccnc1

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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 C25H21N3O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4S/c29-18-12-20(32-19-9-3-1-7-16(18)19)23(30)28-25-22(17-8-2-4-10-21(17)33-25)24(31)27-14-15-6-5-11-26-13-15/h1,3,5-7,9,11-13H,2,4,8,10,14H2,(H,27,31)(H,28,30)
InChIKey
ZADRBNGOFZZDCD-UHFFFAOYSA-N
Synonyms
879565-96-5
4oxoN(3((pyridin3ylmethyl)carbamoyl)4567tetrahydro1benzothiophen2yl)4Hchromene2carboxamide
4oxoN(3((pyridin3ylmethyl)carbamoyl)4567tetrahydrobenzo(b)thiophen2yl)4Hchromene2carboxamide
4oxoN(3(pyridin3ylmethylcarbamoyl)4567tetrahydro1benzothiophen2yl)chromene2carboxamide
879565965
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3)C(=O)NCC5=CN=CC=C5
InChI=1SC25H21N3O4Sc29181220(3219931716(18)19)23(30)282522(178241021(17)3325)24(31)2714156511261315h135791113H2481014H2(H2731)(H2830)
MFCD06648987
ZINC000008612262
ZINC08612262
ZINC8612262

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Available files

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