Vitas-M small molecule compound
methyl 4-methoxy-3-[(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)methyl]benzoate
Catalog ID
STK573523
SMILES COC(=O)c1ccc(c(c1)Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)OC
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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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c1-29-18-9-8-14(22(28)30-2)12-15(18)13-26-17-7-4-3-6-16(17)19-20(26)21(27)25-10-5-11-31-23(25)24-19/h3-4,6-9,12H,5,10-11,13H2,1-2H3InChIKey
HYGRSPVULHVOJQ-UHFFFAOYSA-NSynonyms
879564-98-4879564984
COC1=C(C=C(C=C1)C(=O)OC)CN2C3=CC=CC=C3C4=C2C(=O)N5CCCSC5=N4
InChI=1SC23H21N3O4Sc129189814(22(28)302)1215(18)132617743616(17)1920(26)21(27)25105113123(25)2419h346912H5101113H212H3
methyl4methoxy3((6oxo34dihydro2H(13)thiazino(3212)pyrimido(54b)indol7(6H)yl)methyl)benzoate
MFCD07642146
ZINC000008974237
ZINC08974237
ZINC8974237
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