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

Systemtic Name: N-butan-2-yl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]pentanamide Openeye Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-sec-butyl-pentanamide CAS Name: N-butan-2-yl-N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]pentanamide IUPAC Name: N-butan-2-yl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]pentanamide Traditional Name: N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-sec-butyl-valeramide Formula: C29H42ClN3O2 MolecularWeight: 500.11568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H42ClN3O2/c1-4-6-18-28(34)32(23(3)5-2)22-29(35)33(25-14-8-7-9-15-25)21-26-16-12-19-31(26)20-24-13-10-11-17-27(24)30/h10-13,16-17,19,23,25H,4-9,14-15,18,20-22H2,1-3H3