N-butan-2-yl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-butan-2-yl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-sec-butyl-adamantane-1-carboxamide CAS Name: N-butan-2-yl-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-butan-2-yladamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-sec-butyl-adamantane-1-carboxamide Formula: C30H41N3O2 MolecularWeight: 475.66544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C30H41N3O2/c1-4-22(2)33(29(35)30-16-24-13-25(17-30)15-26(14-24)18-30)21-28(34)32(19-23-9-6-5-7-10-23)20-27-11-8-12-31(27)3/h5-12,22,24-26H,4,13-21H2,1-3H3