Vitas-M small molecule compound
N-(2,5-dimethylphenyl)-2-{[6-(3-methoxybenzyl)-5,5-dioxido-6H-pyrimido[5,4-c][2,1]benzothiazin-2-yl]sulfanyl}acetamide
Catalog ID
STL192436
SMILES COc1cccc(c1)CN1c2ccccc2c2c(S1(=O)=O)cnc(n2)SCC(=O)Nc1cc(C)ccc1C
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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 C28H26N4O4S2 MW 546.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4S2/c1-18-11-12-19(2)23(13-18)30-26(33)17-37-28-29-15-25-27(31-28)22-9-4-5-10-24(22)32(38(25,34)35)16-20-7-6-8-21(14-20)36-3/h4-15H,16-17H2,1-3H3,(H,30,33)InChIKey
BZWGCWBQYSUZJZ-UHFFFAOYSA-NSynonyms
892313-14-3892313143
CC1=CC(=C(C=C1)C)NC(=O)CSC2=NC=C3C(=N2)C4=CC=CC=C4N(S3(=O)=O)CC5=CC(=CC=C5)OC
InChI=1SC28H26N4O4S2c118111219(2)23(1318)3026(33)17372829152527(3128)229451024(22)32(38(2534)35)162076821(1420)363h415H1617H213H3(H3033)
MFCD14727360
N(25DIMETHYLPHENYL)2((6(3METHOXYBENZYL)55DIOXIDO6HBENZO(C)PYRIMIDO(45E)(12)THIAZIN2YL)THIO)ACETAMIDE
N(25dimethylphenyl)2((6(3methoxybenzyl)55dioxido6Hpyrimido(54c)(21)benzothiazin2yl)sulfanyl)acetamide
N(25DIMETHYLPHENYL)2((6(3METHOXYBENZYL)55DIOXIDO6HPYRIMIDO(54C)(21)BENZOTHIAZIN2YL)THIO)ACETAMIDE
N(25dimethylphenyl)2(6((3methoxyphenyl)methyl)55dioxopyrimido(54c)(21)benzothiazin2yl)sulfanylacetamide
ZINC000100032995
ZINC100032995
Check stock
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Check stock on Vitas-MAvailable files
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