N-(3-methylbutan-2-yl)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide

Systemtic Name: N-(3-methylbutan-2-yl)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide Openeye Name: N-(1,2-dimethylpropyl)-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide CAS Name: N-(3-methylbutan-2-yl)-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-(3-methylbutan-2-yl)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide Traditional Name: N-(1,2-dimethylpropyl)-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide Formula: C29H40N2O MolecularWeight: 432.6407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(C(C)C(C)C)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(C(C)C(C)C)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H40N2O/c1-20(2)22(4)31(28(32)29-15-24-12-25(16-29)14-26(13-24)17-29)19-27-9-6-10-30(27)18-23-8-5-7-21(3)11-23/h5-11,20,22,24-26H,12-19H2,1-4H3