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

Systemtic Name: N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-yl-adamantane-1-carboxamide Openeye Name: N-isopropyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide CAS Name: N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-propan-2-yl-1-adamantanecarboxamide IUPAC Name: N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-yladamantane-1-carboxamide Traditional Name: N-isopropyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide Formula: C27H36N2O MolecularWeight: 404.58754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36N2O/c1-19(2)29(26(30)27-14-22-11-23(15-27)13-24(12-22)16-27)18-25-8-5-9-28(25)17-21-7-4-6-20(3)10-21/h4-10,19,22-24H,11-18H2,1-3H3