Vitas-M small molecule compound
N-[(2E)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]-2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Catalog ID
STL249471
SMILES COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)/N=c/1\[nH]nc(s1)C1CC1
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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 C23H28N4O3S MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3S/c1-30-14-13-27-21(29)17-8-4-3-7-16(17)18(23(27)11-5-2-6-12-23)19(28)24-22-26-25-20(31-22)15-9-10-15/h3-4,7-8,15,18H,2,5-6,9-14H2,1H3,(H,24,26,28)InChIKey
OOPLARIIEJRORT-UHFFFAOYSA-NSynonyms
1351671-56-11351671561
COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)N=c1(nH)nc(s1)C1CC1
MFCD24861541
N((2E)5cyclopropyl134thiadiazol2(3H)ylidene)2(2methoxyethyl)1oxo14dihydro2Hspiro(cyclohexane13isoquinoline)4carboxamide
ZINC000072401849
ZINC000072401850
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