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

Systemtic Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]butanamide Openeye Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]butanamide CAS Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]butanamide IUPAC Name: N-butyl-N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]butanamide Traditional Name: N-butyl-N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]butyramide 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)CCC

Isomeric SMILES

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

InChI

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