3-cyclopentyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-propyl-propanamide

Systemtic Name: 3-cyclopentyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-propyl-propanamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-oxo-ethyl]-3-cyclopentyl-N-propyl-propanamide CAS Name: 3-cyclopentyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-N-propylpropanamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropylamino]-2-oxoethyl]-3-cyclopentyl-N-propylpropanamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-keto-ethyl]-3-cyclopentyl-N-propyl-propionamide Formula: C28H39N3O2 MolecularWeight: 449.62816

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)CCC4CCCC4

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)CCC4CCCC4

InChI

InChI=1S/C28H39N3O2/c1-2-18-30(27(32)17-14-23-9-6-7-10-23)22-28(33)31(25-15-16-25)21-26-13-8-19-29(26)20-24-11-4-3-5-12-24/h3-5,8,11-13,19,23,25H,2,6-7,9-10,14-18,20-22H2,1H3