N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(oxolan-2-ylmethyl)adamantane-1-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(oxolan-2-ylmethyl)adamantane-1-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-(tetrahydrofuran-2-ylmethyl)adamantane-1-carboxamide CAS Name: N-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-N-(2-oxolanylmethyl)-1-adamantanecarboxamide IUPAC Name: N-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(oxolan-2-ylmethyl)adamantane-1-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-(tetrahydrofurfuryl)adamantane-1-carboxamide Formula: C31H39FN2O3S MolecularWeight: 538.716363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(CC3CCCO3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(CC3CCCO3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H39FN2O3S/c1-21-8-10-38-28(21)19-33(17-22-4-6-26(32)7-5-22)29(35)20-34(18-27-3-2-9-37-27)30(36)31-14-23-11-24(15-31)13-25(12-23)16-31/h4-8,10,23-25,27H,2-3,9,11-20H2,1H3