N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-2-methyl-propanamide

Systemtic Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-2-methyl-propanamide Openeye Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-2-methyl-propanamide CAS Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-2-methylpropanamide IUPAC Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-2-methylpropanamide Traditional Name: N-butyl-N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-2-methyl-propionamide Formula: C28H40ClN3O2 MolecularWeight: 486.0891

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C(C)C

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C(C)C

InChI

InChI=1S/C28H40ClN3O2/c1-4-5-17-31(28(34)22(2)3)21-27(33)32(24-13-7-6-8-14-24)20-25-15-11-18-30(25)19-23-12-9-10-16-26(23)29/h9-12,15-16,18,22,24H,4-8,13-14,17,19-21H2,1-3H3