Vitas-M small molecule compound
ethyl 2-[2-amino-4-(4-bromophenyl)-3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK674552
SMILES CCOC(=O)c1c(sc2c1CCCC2)N1C(=C(C#N)C(C2=C1CCCC2=O)c1ccc(cc1)Br)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 C27H26BrN3O3S MW 552.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN3O3S/c1-2-34-27(33)23-17-6-3-4-9-21(17)35-26(23)31-19-7-5-8-20(32)24(19)22(18(14-29)25(31)30)15-10-12-16(28)13-11-15/h10-13,22H,2-9,30H2,1H3InChIKey
TTWBNZKZCUXNPR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)N3C4=C(C(C(=C3N)C#N)C5=CC=C(C=C5)Br)C(=O)CCC4
ethyl2(2amino4(4bromophenyl)3cyano5oxo4678tetrahydroquinolin1yl)4567tetrahydro1benzothiophene3carboxylate
ethyl2(2amino4(4bromophenyl)3cyano5oxo5678tetrahydroquinolin1(4H)yl)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC27H26BrN3O3Sc123427(33)2317634921(17)3526(23)311975820(32)24(19)22(18(1429)25(31)30)15101216(28)131115h101322H2930H21H3
MFCD01465171
ZINC000003666733
ZINC000003666734
Check stock
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