N-(3-methoxypropyl)-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]adamantane-1-carboxamide

Systemtic Name: N-(3-methoxypropyl)-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide CAS Name: N-(3-methoxypropyl)-N-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Traditional Name: N-[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-N-(3-methoxypropyl)adamantane-1-carboxamide Formula: C29H38N2O3S MolecularWeight: 494.68862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H38N2O3S/c1-34-11-6-10-30(28(33)29-16-23-13-24(17-29)15-25(14-23)18-29)21-27(32)31(20-26-9-5-12-35-26)19-22-7-3-2-4-8-22/h2-5,7-9,12,23-25H,6,10-11,13-21H2,1H3