Vitas-M small molecule compound
N-[(2E)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Catalog ID
STL163187
SMILES O=C(c1cn(C)c(=O)c2c1cccc2)/N=c\1/sc2c([nH]1)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 C19H19N3O2S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S/c1-22-11-14(12-7-5-6-8-13(12)18(22)24)17(23)21-19-20-15-9-3-2-4-10-16(15)25-19/h5-8,11H,2-4,9-10H2,1H3,(H,20,21,23)InChIKey
OQQNRPGYOGMRCA-UHFFFAOYSA-NSynonyms
1282110-09-11282110091
2methyl1oxoN(5678tetrahydro4Hcyclohepta(d)(13)thiazol2yl)isoquinoline4carboxamide
CN1C=C(C2=CC=CC=C2C1=O)C(=O)NC3=NC4=C(S3)CCCCC4
InChI=1SC19H19N3O2Sc1221114(12756813(12)18(22)24)17(23)2119201593241016(15)2519h5811H24910H21H3(H202123)
MFCD20759945
N((2E)345678hexahydro2Hcyclohepta(d)(13)thiazol2ylidene)2methyl1oxo12dihydroisoquinoline4carboxamide
O=C(c1cn(C)c(=O)c2c1cccc2)N=c1sc2c((nH)1)CCCCC2
ZINC000061718425
ZINC61718425
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