N-(2-methoxyethyl)-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-(2-methoxyethyl)-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-(2-methoxyethyl)adamantane-1-carboxamide CAS Name: N-(2-methoxyethyl)-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)adamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-(2-methoxyethyl)adamantane-1-carboxamide Formula: C29H38N2O3S MolecularWeight: 494.68862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CCOC)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CCOC)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H38N2O3S/c1-21-8-9-26(35-21)19-31(18-22-6-4-3-5-7-22)27(32)20-30(10-11-34-2)28(33)29-15-23-12-24(16-29)14-25(13-23)17-29/h3-9,23-25H,10-20H2,1-2H3