Vitas-M small molecule compound
2-(benzylsulfanyl)-4-(prop-2-en-1-ylamino)-3-azaspiro[5.5]undeca-1,4-diene-1,5-dicarbonitrile
Catalog ID
STL109890
SMILES C=CCNC1=C(C#N)C2(C(=C(N1)SCc1ccccc1)C#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 C22H24N4S MW 376.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4S/c1-2-13-25-20-18(14-23)22(11-7-4-8-12-22)19(15-24)21(26-20)27-16-17-9-5-3-6-10-17/h2-3,5-6,9-10,25-26H,1,4,7-8,11-13,16H2InChIKey
XNIFSGHFSJDCPA-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)4(prop2en1ylamino)3azaspiro(55)undeca14diene15dicarbonitrile
4benzylsulfanyl2(prop2enylamino)3azaspiro(55)undeca14diene15dicarbonitrile
C=CCNC1=C(C2(CCCCC2)C(=C(N1)SCC3=CC=CC=C3)C#N)C#N
InChI=1SC22H24N4Sc1213252018(1423)22(117481222)19(1524)21(2620)27161795361017h23569102526H1478111316H2
MFCD20737315
ZINC000067257834
ZINC67257834
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