Vitas-M small molecule compound

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

Catalog ID
STL291023
SMILES O=C(NC(C)(C)C)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 C20H23N5O3S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3S/c1-20(2,3)23-18(26)10-13-25(22-14-15-8-11-21-12-9-15)19-16-6-4-5-7-17(16)29(27,28)24-19/h4-9,11-12,14H,10,13H2,1-3H3,(H,23,26)/b22-14+
InChIKey
AZSNDEZIJQDPGR-HYARGMPZSA-N
Synonyms

CC(C)(C)NC(=O)CCN(C1=NS(=O)(=O)C2=CC=CC=C21)N=CC3=CC=NC=C3
InChI=1SC20H23N5O3Sc120(23)2318(26)101325(2214158112112915)1916645717(16)29(2728)2419h49111214H1013H213H3(H2326)b2214+
MFCD03215050
N(TERTBUTYL)3((2E)1(11DIOXIDO12BENZISOTHIAZOL3YL)2(PYRIDIN4YLMETHYLENE)HYDRAZINO)PROPANAMIDE
Ntertbutyl3((11dioxo12benzothiazol3yl)((E)pyridin4ylmethylideneamino)amino)propanamide
Ntertbutyl3((2E)1(11dioxido12benzothiazol3yl)2(pyridin4ylmethylidene)hydrazinyl)propanamide
O=C(NC(C)(C)C)CCN(C1=NS(=O)(=O)c2c1cccc2)N=Cc1ccncc1
ZINC000005837619
ZINC13139720

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Available files

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