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

Systemtic Name: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-sec-butyl-adamantane-1-carboxamide CAS Name: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-butan-2-yl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)-(2-thenyl)amino]-2-keto-ethyl]-N-sec-butyl-adamantane-1-carboxamide Formula: C29H37FN2O2S MolecularWeight: 496.679683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37FN2O2S/c1-3-20(2)32(28(34)29-14-22-11-23(15-29)13-24(12-22)16-29)19-27(33)31(18-26-5-4-10-35-26)17-21-6-8-25(30)9-7-21/h4-10,20,22-24H,3,11-19H2,1-2H3