N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-3-methyl-N-propan-2-yl-butanamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-3-methyl-N-propan-2-yl-butanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-isopropyl-3-methyl-butanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-3-methyl-N-propan-2-ylbutanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-3-methyl-N-propan-2-ylbutanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-isopropyl-3-methyl-butyramide Formula: C28H40BrN3O2 MolecularWeight: 530.5401

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(C)C

Isomeric SMILES

CC(C)CC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=C(C=C2)Br)C3CCCCC3)C(C)C

InChI

InChI=1S/C28H40BrN3O2/c1-21(2)17-27(33)31(22(3)4)20-28(34)32(25-9-6-5-7-10-25)19-26-11-8-16-30(26)18-23-12-14-24(29)15-13-23/h8,11-16,21-22,25H,5-7,9-10,17-20H2,1-4H3