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

Systemtic Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]propanamide Openeye Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]propanamide CAS Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]propanamide IUPAC Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]propanamide Traditional Name: N-butyl-N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]propionamide Formula: C27H38ClN3O2 MolecularWeight: 472.06252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38ClN3O2/c1-3-5-17-30(26(32)4-2)21-27(33)31(23-13-7-6-8-14-23)20-24-15-11-18-29(24)19-22-12-9-10-16-25(22)28/h9-12,15-16,18,23H,3-8,13-14,17,19-21H2,1-2H3