N-butyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]cyclopentanecarboxamide

Systemtic Name: N-butyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]cyclopentanecarboxamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-butyl-cyclopentanecarboxamide CAS Name: N-butyl-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]cyclopentanecarboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-butylcyclopentanecarboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-butyl-cyclopentanecarboxamide Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3CCCC3

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3CCCC3

InChI

InChI=1S/C25H35N3O2/c1-3-4-17-27(25(30)22-13-8-9-14-22)20-24(29)28(18-21-11-6-5-7-12-21)19-23-15-10-16-26(23)2/h5-7,10-12,15-16,22H,3-4,8-9,13-14,17-20H2,1-2H3