N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-4-phenyl-benzamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-4-phenyl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-pentyl-4-phenyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-pentyl-4-phenylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-pentyl-4-phenylbenzamide Traditional Name: N-amyl-N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-4-phenyl-benzamide Formula: C36H42BrN3O2 MolecularWeight: 628.64158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C36H42BrN3O2/c1-3-5-10-24-40(36(42)32-19-17-31(18-20-32)30-12-8-7-9-13-30)28-35(41)39(23-6-4-2)27-34-14-11-25-38(34)26-29-15-21-33(37)22-16-29/h7-9,11-22,25H,3-6,10,23-24,26-28H2,1-2H3