N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-3-methyl-butanamide

Systemtic Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-3-methyl-butanamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-oxo-ethyl]-N-butyl-3-methyl-butanamide CAS Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-3-methylbutanamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropylamino]-2-oxoethyl]-N-butyl-3-methylbutanamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-keto-ethyl]-N-butyl-3-methyl-butyramide Formula: C26H37N3O2 MolecularWeight: 423.59088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37N3O2/c1-4-5-15-28(25(30)17-21(2)3)20-26(31)29(23-13-14-23)19-24-12-9-16-27(24)18-22-10-7-6-8-11-22/h6-12,16,21,23H,4-5,13-15,17-20H2,1-3H3