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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C=CCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H33FN2O2S/c1-2-9-30(27(33)28-14-21-11-22(15-28)13-23(12-21)16-28)19-26(32)31(18-25-4-3-10-34-25)17-20-5-7-24(29)8-6-20/h2-8,10,21-23H,1,9,11-19H2