(2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-(1-adamantyl)ethanoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-(1-adamantyl)ethanoate Openeye Name: (2-anilinothiazol-4-yl)methyl 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid (2-anilinothiazol-4-yl)methyl ester Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

InChI

InChI=1S/C22H26N2O2S/c25-20(12-22-9-15-6-16(10-22)8-17(7-15)11-22)26-13-19-14-27-21(24-19)23-18-4-2-1-3-5-18/h1-5,14-17H,6-13H2,(H,23,24)