N-(1-adamantyl)-4-[(4-propan-2-ylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[(4-propan-2-ylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-(1-adamantyl)-4-[(4-isopropylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-(1-adamantyl)-4-[(4-propan-2-ylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-(1-adamantyl)-4-[(4-propan-2-ylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(1-adamantyl)-4-[(4-isopropylphenoxy)methyl]thiophene-2-carboxamide Formula: C25H31NO2S MolecularWeight: 409.58414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO2S/c1-16(2)21-3-5-22(6-4-21)28-14-20-10-23(29-15-20)24(27)26-25-11-17-7-18(12-25)9-19(8-17)13-25/h3-6,10,15-19H,7-9,11-14H2,1-2H3,(H,26,27)