Vitas-M small molecule compound
ethyl 2-[(N-benzylglycyl)amino]-3-[(4-bromophenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Catalog ID
STK385257
SMILES CCOC(=O)N1CCc2c(C1)sc(c2C(=O)Nc1ccc(cc1)Br)NC(=O)CNCc1ccccc1
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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 C26H27BrN4O4S MW 571.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27BrN4O4S/c1-2-35-26(34)31-13-12-20-21(16-31)36-25(23(20)24(33)29-19-10-8-18(27)9-11-19)30-22(32)15-28-14-17-6-4-3-5-7-17/h3-11,28H,2,12-16H2,1H3,(H,29,33)(H,30,32)InChIKey
OOULQGWHXPAVTE-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Br)NC(=O)CNCC4=CC=CC=C4
ETHYL2((2(BENZYLAMINO)ACETYL)AMINO)3((4BROMOPHENYL)CARBAMOYL)57DIHYDRO4HTHIENO(23C)PYRIDINE6CARBOXYLATE
ETHYL2((NBENZYLGLYCYL)AMINO)3((4BROMOPHENYL)CARBAMOYL)47DIHYDROTHIENO(23C)PYRIDINE6(5H)CARBOXYLATE
InChI=1SC26H27BrN4O4Sc123526(34)3113122021(1631)3625(23(20)24(33)291910818(27)91119)3022(32)152814176435717h31128H21216H21H3(H2933)(H3032)
MFCD03274094
ZINC000101891871
ZINC101891871
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