Vitas-M small molecule compound
N-[(2E)-4-ethyl-5-methyl-1,3-thiazol-2(3H)-ylidene]-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL155202
SMILES COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)/N=c\1/sc(c([nH]1)CC)C
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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 C23H29N3O3S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O3S/c1-4-18-15(2)30-22(24-18)25-20(27)19-16-9-5-6-10-17(16)21(28)26(13-14-29-3)23(19)11-7-8-12-23/h5-6,9-10,19H,4,7-8,11-14H2,1-3H3,(H,24,25,27)InChIKey
CNNWYBMQXRSZNB-UHFFFAOYSA-NSynonyms
1246038-39-01246038390
CCC1=C(SC(=N1)NC(=O)C2C3=CC=CC=C3C(=O)N(C24CCCC4)CCOC)C
COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)N=c1sc(c((nH)1)CC)C
InChI=1SC23H29N3O3Sc141815(2)3022(2418)2520(27)19169561017(16)21(28)26(1314293)23(19)11781223h5691019H4781114H213H3(H242527)
MFCD20757225
N((2E)4ethyl5methyl13thiazol2(3H)ylidene)2(2methoxyethyl)1oxo14dihydro2Hspiro(cyclopentane13isoquinoline)4carboxamide
N(4ethyl5methyl13thiazol2yl)2(2methoxyethyl)1oxospiro(4Hisoquinoline31cyclopentane)4carboxamide
ZINC000049551031
ZINC000049551033
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