Vitas-M small molecule compound
1,4-bis(4-chlorophenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK544070
SMILES C=CCNC(=S)c1n2cc(n3c2c(c1c1ccc(cc1)Cl)CCCC3)c1ccc(cc1)Cl
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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 C26H23Cl2N3S MW 480.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N3S/c1-2-14-29-25(32)24-23(18-8-12-20(28)13-9-18)21-5-3-4-15-30-22(16-31(24)26(21)30)17-6-10-19(27)11-7-17/h2,6-13,16H,1,3-5,14-15H2,(H,29,32)InChIKey
CCUVGFYYWBBOOZ-UHFFFAOYSA-NSynonyms
497231-57-914bis(4chlorophenyl)N(prop2en1yl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
497231579
C=CCNC(=S)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl
InChI=1SC26H23Cl2N3Sc12142925(32)2423(1881220(28)13918)21534153022(1631(24)26(21)30)1761019(27)11717h261316H1351415H2(H2932)
MFCD03300709
Nallyl14bis(4chlorophenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000001792125
ZINC01792125
ZINC1792125
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