Vitas-M small molecule compound
2-amino-4-(4-methoxyphenyl)-6-(3-methylbenzyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL081749
SMILES COc1ccc(cc1)C1C(=C(N)OC2=C1S(=O)(=O)N(c1c2cccc1)Cc1cccc(c1)C)C#N
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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 C27H23N3O4S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O4S/c1-17-6-5-7-18(14-17)16-30-23-9-4-3-8-21(23)25-26(35(30,31)32)24(22(15-28)27(29)34-25)19-10-12-20(33-2)13-11-19/h3-14,24H,16,29H2,1-2H3InChIKey
IJNLPUDVQMEWGM-UHFFFAOYSA-NSynonyms
893297-95-52amino4(4methoxyphenyl)6((3methylphenyl)methyl)55dioxo4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO4(4METHOXYPHENYL)6(3METHYLBENZYL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino4(4methoxyphenyl)6(3methylbenzyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
893297955
CC1=CC(=CC=C1)CN2C3=CC=CC=C3C4=C(S2(=O)=O)C(C(=C(O4)N)C#N)C5=CC=C(C=C5)OC
InChI=1SC27H23N3O4Sc11765718(1417)163023943821(23)2526(35(3031)32)24(22(1528)27(29)3425)19101220(332)131119h31424H1629H212H3
MFCD14914497
ZINC000020558634
ZINC000020558636
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