N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]cyclobutanecarboxamide

Systemtic Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]cyclobutanecarboxamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-oxo-ethyl]-N-butyl-cyclobutanecarboxamide CAS Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]cyclobutanecarboxamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropylamino]-2-oxoethyl]-N-butylcyclobutanecarboxamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-keto-ethyl]-N-butyl-cyclobutanecarboxamide Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)C4CCC4

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)C4CCC4

InChI

InChI=1S/C26H35N3O2/c1-2-3-16-28(26(31)22-11-7-12-22)20-25(30)29(23-14-15-23)19-24-13-8-17-27(24)18-21-9-5-4-6-10-21/h4-6,8-10,13,17,22-23H,2-3,7,11-12,14-16,18-20H2,1H3