Vitas-M small molecule compound
9-methyl-1-(2-methylphenyl)-4-oxo-2-sulfanyl-1,5-diazaspiro[5.5]undec-2-ene-3-carbonitrile
Catalog ID
STK948612
SMILES N#CC1=C(S)N(C2(NC1=O)CCC(CC2)C)c1ccccc1C
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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 C18H21N3OS MW 327.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3OS/c1-12-7-9-18(10-8-12)20-16(22)14(11-19)17(23)21(18)15-6-4-3-5-13(15)2/h3-6,12,23H,7-10H2,1-2H3,(H,20,22)InChIKey
UJYQBDDCDMHPQW-UHFFFAOYSA-NSynonyms
9methyl1(2methylphenyl)4oxo2sulfanyl15diazaspiro(55)undec2ene3carbonitrile
9methyl5(2methylphenyl)2oxo4sulfanyl15diazaspiro(55)undec3ene3carbonitrile
CC1CCC2(CC1)NC(=O)C(=C(N2C3=CC=CC=C3C)S)C#N
InChI=1SC18H21N3OSc1127918(10812)2016(22)14(1119)17(23)21(18)15643513(15)2h361223H710H212H3(H2022)
MFCD07523873
ZINC000036635915
ZINC36635915
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