Vitas-M small molecule compound

2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N-(3-chlorophenyl)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carboxamide

Catalog ID
STK131652
SMILES O=C(C1CC(=O)N=C(S1)N/N=C/c1ccc2c(c1)OCO2)Nc1cccc(c1)Cl

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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 C19H15ClN4O4S MW 430.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN4O4S/c20-12-2-1-3-13(7-12)22-18(26)16-8-17(25)23-19(29-16)24-21-9-11-4-5-14-15(6-11)28-10-27-14/h1-7,9,16H,8,10H2,(H,22,26)(H,23,24,25)/b21-9+
InChIKey
DBNJDXHMZNFGMM-ZVBGSRNCSA-N
Synonyms
488723-97-3
(2(((1E)2(2HBENZO(34D)13DIOXOLEN5YL)1AZAVINYL)AMINO)4OXO(56DIHYDRO13THIAZIN6YL))N(3CHLOROPHENYL)CARBOXAMIDE
(E)2(2(benzo(d)(13)dioxol5ylmethylene)hydrazinyl)N(3chlorophenyl)4oxo56dihydro4H13thiazine6carboxamide
2((2E)2(13benzodioxol5ylmethylidene)hydrazinyl)N(3chlorophenyl)4oxo56dihydro13thiazine6carboxamide
2((2E)2(13BENZODIOXOL5YLMETHYLIDENE)HYDRAZINYL)N(3CHLOROPHENYL)4OXO56DIHYDRO4H13THIAZINE6CARBOXAMIDE
488723973
C1C(SC(=NC1=O)NN=CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC(=CC=C4)Cl
InChI=1SC19H15ClN4O4Sc201221313(712)2218(26)16817(25)2319(2916)2421911451415(611)28102714h17916H810H2(H2226)(H232425)b219+
MFCD03291383
O=C(C1CC(=O)N=C(S1)NN=Cc1ccc2c(c1)OCO2)Nc1cccc(c1)Cl
ZINC000002337684
ZINC000002337687

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.