Vitas-M small molecule compound
5-(4-bromophenyl)-N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)furan-2-carboxamide
Catalog ID
STK892777
SMILES Brc1ccc(cc1)c1ccc(o1)C(=O)Nc1sc2c(c1C(=O)N)CCCCC2
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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 C21H19BrN2O3S MW 459.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O3S/c22-13-8-6-12(7-9-13)15-10-11-16(27-15)20(26)24-21-18(19(23)25)14-4-2-1-3-5-17(14)28-21/h6-11H,1-5H2,(H2,23,25)(H,24,26)InChIKey
HKRKHOYIAPLOMB-UHFFFAOYSA-NSynonyms
5(4bromophenyl)N(3carbamoyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)furan2carboxamide
C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br
InChI=1SC21H19BrN2O3Sc22138612(7913)15101116(2715)20(26)242118(19(23)25)144213517(14)2821h611H15H2(H22325)(H2426)
MFCD08067825
ZINC000008904563
ZINC08904563
ZINC8904563
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