N-cyclopropyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-cyclopropyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-cyclopropyl-N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-cyclopropyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-cyclopropyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-cyclopropyl-N-[2-[(4-fluorobenzyl)-(2-thenyl)amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C28H33FN2O2S MolecularWeight: 480.637223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC1N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H33FN2O2S/c29-23-5-3-19(4-6-23)16-30(17-25-2-1-9-34-25)26(32)18-31(24-7-8-24)27(33)28-13-20-10-21(14-28)12-22(11-20)15-28/h1-6,9,20-22,24H,7-8,10-18H2