Vitas-M small molecule compound
N-[2-({1-[(4-bromophenyl)amino]-1-oxobutan-2-yl}sulfanyl)-1,3-benzothiazol-6-yl]-4-methoxybenzamide
Catalog ID
STK139277
SMILES COc1ccc(cc1)C(=O)Nc1ccc2c(c1)sc(n2)SC(C(=O)Nc1ccc(cc1)Br)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 C25H22BrN3O3S2 MW 556.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN3O3S2/c1-3-21(24(31)27-17-8-6-16(26)7-9-17)33-25-29-20-13-10-18(14-22(20)34-25)28-23(30)15-4-11-19(32-2)12-5-15/h4-14,21H,3H2,1-2H3,(H,27,31)(H,28,30)InChIKey
YXZJCQCBVQJWBI-UHFFFAOYSA-NSynonyms
CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)OC
InChI=1SC25H22BrN3O3S2c1321(24(31)27178616(26)7917)33252920131018(1422(20)3425)2823(30)1541119(322)12515h41421H3H212H3(H2731)(H2830)
MFCD04092391
N(2((1((4BROMOANILINO)CARBONYL)PROPYL)SULFANYL)13BENZOTHIAZOL6YL)4METHOXYBENZAMIDE
N(2((1((4BROMOPHENYL)AMINO)1OXOBUTAN2YL)SULFANYL)13BENZOTHIAZOL6YL)4METHOXYBENZAMIDE
N(2(1(4BROMOANILINO)1OXOBUTAN2YL)SULFANYL13BENZOTHIAZOL6YL)4METHOXYBENZAMIDE
ZINC000008438247
ZINC000008438249
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