Vitas-M small molecule compound
9-methyl-4-oxo-1-phenyl-2-sulfanyl-1,5-diazaspiro[5.5]undec-2-ene-3-carbonitrile
Catalog ID
STL022448
SMILES N#CC1=C(S)N(C2(NC1=O)CCC(CC2)C)c1ccccc1
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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 C17H19N3OS MW 313.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3OS/c1-12-7-9-17(10-8-12)19-15(21)14(11-18)16(22)20(17)13-5-3-2-4-6-13/h2-6,12,22H,7-10H2,1H3,(H,19,21)InChIKey
JQNHRAQLKCUEJR-UHFFFAOYSA-NSynonyms
3METHYL8OXO11PHENYL10SULFANYL711DIAZASPIRO(55)UNDEC9ENE9CARBONITRILE
9methyl2oxo5phenyl4sulfanyl15diazaspiro(55)undec3ene3carbonitrile
9methyl4oxo1phenyl2sulfanyl15diazaspiro(55)undec2ene3carbonitrile
CC1CCC2(CC1)NC(=O)C(=C(N2C3=CC=CC=C3)S)C#N
InChI=1SC17H19N3OSc1127917(10812)1915(21)14(1118)16(22)20(17)135324613h261222H710H21H3(H1921)
MFCD06625813
ZINC000001893330
ZINC01893330
ZINC1893330
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