Vitas-M small molecule compound
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(4-phenylpiperazin-1-yl)sulfonyl]benzamide
Catalog ID
STK769399
SMILES N#Cc1c(NC(=O)c2cccc(c2)S(=O)(=O)N2CCN(CC2)c2ccccc2)sc2c1CCC(C2)C
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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 C27H28N4O3S2 MW 520.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S2/c1-19-10-11-23-24(18-28)27(35-25(23)16-19)29-26(32)20-6-5-9-22(17-20)36(33,34)31-14-12-30(13-15-31)21-7-3-2-4-8-21/h2-9,17,19H,10-16H2,1H3,(H,29,32)InChIKey
ZXKILYLSFAYJRX-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5
InChI=1SC27H28N4O3S2c11910112324(1828)27(3525(23)1619)2926(32)2065922(1720)36(3334)31141230(131531)217324821h291719H1016H21H3(H2932)
MFCD03409007
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)3((4phenylpiperazin1yl)sulfonyl)benzamide
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)3(4phenylpiperazin1yl)sulfonylbenzamide
ZINC000008846689
ZINC000008846690
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