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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-3,3-dimethyl-N-propan-2-yl-butanamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-isopropyl-3,3-dimethyl-butanamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-3,3-dimethyl-N-propan-2-ylbutanamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-3,3-dimethyl-N-propan-2-ylbutanamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-N-isopropyl-3,3-dimethyl-butyramide Formula: C27H40BrN3O2 MolecularWeight: 518.5294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)CC(C)(C)C

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)CC(C)(C)C

InChI

InChI=1S/C27H40BrN3O2/c1-7-8-15-30(26(33)20-31(21(2)3)25(32)17-27(4,5)6)19-24-10-9-16-29(24)18-22-11-13-23(28)14-12-22/h9-14,16,21H,7-8,15,17-20H2,1-6H3