Vitas-M small molecule compound

N-cyclohexyl-3-[(2E)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(pyridin-4-ylmethylidene)hydrazinyl]propanamide

Catalog ID
STL291029
SMILES O=C(NC1CCCCC1)CCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1ccncc1

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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 C22H25N5O3S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3S/c28-21(25-18-6-2-1-3-7-18)12-15-27(24-16-17-10-13-23-14-11-17)22-19-8-4-5-9-20(19)31(29,30)26-22/h4-5,8-11,13-14,16,18H,1-3,6-7,12,15H2,(H,25,28)/b24-16+
InChIKey
NWESUGYZQJBOFC-LFVJCYFKSA-N
Synonyms

C1CCC(CC1)NC(=O)CCN(C2=NS(=O)(=O)C3=CC=CC=C32)N=CC4=CC=NC=C4
InChI=1SC22H25N5O3Sc2821(25186213718)121527(241617101323141117)2219845920(19)31(2930)2622h4581113141618H13671215H2(H2528)b2416+
MFCD03215113
Ncyclohexyl3((11dioxo12benzothiazol3yl)((E)pyridin4ylmethylideneamino)amino)propanamide
Ncyclohexyl3((2E)1(11dioxido12benzothiazol3yl)2(pyridin4ylmethylidene)hydrazinyl)propanamide
O=C(NC1CCCCC1)CCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccncc1
ZINC000019630095
ZINC103668535

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Available files

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