Vitas-M small molecule compound

3-chloro-6-methyl-N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide

Catalog ID
STK967486
SMILES O=C1COc2c(N1)cc(cc2)NC(=O)c1sc2c(c1Cl)ccc(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 C18H13ClN2O3S MW 372.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O3S/c1-9-2-4-11-14(6-9)25-17(16(11)19)18(23)20-10-3-5-13-12(7-10)21-15(22)8-24-13/h2-7H,8H2,1H3,(H,20,23)(H,21,22)
InChIKey
ZECDWFWTNFQALO-UHFFFAOYSA-N
Synonyms

3chloro6methylN(3oxo34dihydro2H14benzoxazin6yl)1benzothiophene2carboxamide
3chloro6methylN(3oxo4H14benzoxazin6yl)1benzothiophene2carboxamide
CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC4=C(C=C3)OCC(=O)N4)Cl
InChI=1SC18H13ClN2O3Sc19241114(69)2517(16(11)19)18(23)2010351312(710)2115(22)82413h27H8H21H3(H2023)(H2122)
MFCD12919678
ZINC000027990078
ZINC27990078

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Available files

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