N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(1-adamantyl)-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C24H29NO2S MolecularWeight: 395.55756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC2=CSC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC2=CSC(=C2)C(=O)NC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H29NO2S/c1-15-4-3-5-21(16(15)2)27-13-20-9-22(28-14-20)23(26)25-24-10-17-6-18(11-24)8-19(7-17)12-24/h3-5,9,14,17-19H,6-8,10-13H2,1-2H3,(H,25,26)