Vitas-M small molecule compound
4-amino-2-[(3-chlorophenyl)amino]-5-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)thiophene-3-carbonitrile
Catalog ID
STK081083
SMILES N#Cc1c(Nc2cccc(c2)Cl)sc(c1N)C(=O)C12CC3CC(C2)CC(C1)C3
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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 C22H22ClN3OS MW 411.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3OS/c23-15-2-1-3-16(7-15)26-21-17(11-24)18(25)19(28-21)20(27)22-8-12-4-13(9-22)6-14(5-12)10-22/h1-3,7,12-14,26H,4-6,8-10,25H2InChIKey
KYUDDKBMHQCBJC-UHFFFAOYSA-NSynonyms
340809-19-0340809190
4amino2((3chlorophenyl)amino)5(tricyclo(3311~37~)dec1ylcarbonyl)thiophene3carbonitrile
5((3r5r7r)adamantane1carbonyl)4amino2((3chlorophenyl)amino)thiophene3carbonitrile
5(1ADAMANTYLCARBONYL)4AMINO2(3CHLOROANILINO)3THIOPHENECARBONITRILE
5(ADAMANTANE1CARBONYL)4AMINO2(3CHLOROANILINO)THIOPHENE3CARBONITRILE
C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(C(=C(S4)NC5=CC(=CC=C5)Cl)C#N)N
InChI=1SC22H22ClN3OSc231521316(715)262117(1124)18(25)19(2821)20(27)22812413(922)614(512)1022h137121426H4681025H2
MFCD01835737
N#Cc1c(Nc2cccc(c2)Cl)sc(c1N)C(=O)C12CC3CC(C2)CC(C1)C3
STK081083
ZINC000004652843
ZINC04652843
ZINC4652843
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