Vitas-M small molecule compound
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(4-methoxyphenyl)quinoline-4-carboxamide
Catalog ID
STK429957
SMILES COc1ccc(cc1)c1nc2ccccc2c(c1)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 C27H25N3O3S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O3S/c1-33-17-13-11-16(12-14-17)22-15-20(18-7-5-6-9-21(18)29-22)26(32)30-27-24(25(28)31)19-8-3-2-4-10-23(19)34-27/h5-7,9,11-15H,2-4,8,10H2,1H3,(H2,28,31)(H,30,32)InChIKey
YQHWREBMZQRBJA-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCCC5)C(=O)NN(3carbamoyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(4methoxyphenyl)quinoline4carboxamide
Registry IDs
MFCD01353610ZINC000002740010
ZINC02740010
ZINC2740010
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