N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-heptanamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-heptanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-isopropyl-heptanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-propan-2-ylheptanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-propan-2-ylheptanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-N-isopropyl-enanthamide Formula: C28H42BrN3O2 MolecularWeight: 532.55598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(C)C

Isomeric SMILES

CCCCCCC(=O)N(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(C)C

InChI

InChI=1S/C28H42BrN3O2/c1-5-7-9-10-13-27(33)32(23(3)4)22-28(34)31(18-8-6-2)21-26-12-11-19-30(26)20-24-14-16-25(29)17-15-24/h11-12,14-17,19,23H,5-10,13,18,20-22H2,1-4H3