Vitas-M small molecule compound
2-[(diethylamino)methyl]-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-methoxybenzoate
Catalog ID
STK132031
SMILES CCN(Cc1cc(ccc1OC(=O)c1ccc(cc1)OC)NC1=NS(=O)(=O)c2c1cccc2)CC
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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 C26H27N3O5S MW 493.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5S/c1-4-29(5-2)17-19-16-20(27-25-22-8-6-7-9-24(22)35(31,32)28-25)12-15-23(19)34-26(30)18-10-13-21(33-3)14-11-18/h6-16H,4-5,17H2,1-3H3,(H,27,28)InChIKey
QAVXVZMEFFAVMG-UHFFFAOYSA-NSynonyms
(2(DIETHYLAMINOMETHYL)4((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)4METHOXYBENZOATE
2((DIETHYLAMINO)METHYL)4((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PHENYL4METHOXYBENZOATE
4METHOXYBENZOICACID2DIETHYLAMINOMETHYL4(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YLAMINO)PHENYLESTER
CCN(CC)CC1=C(C=CC(=C1)NC2=NS(=O)(=O)C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)OC
InChI=1SC26H27N3O5Sc1429(52)17191620(272522867924(22)35(3132)2825)121523(19)3426(30)18101321(333)141118h616H4517H213H3(H2728)
MFCD01572830
ZINC000005985495
ZINC5985495
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