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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-4-methyl-N-pentyl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-4-methyl-N-pentyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-4-methyl-N-pentylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-4-methyl-N-pentylbenzamide Traditional Name: N-amyl-N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-4-methyl-benzamide Formula: C31H40BrN3O2 MolecularWeight: 566.5722

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C31H40BrN3O2/c1-4-6-8-20-35(31(37)27-15-11-25(3)12-16-27)24-30(36)34(19-7-5-2)23-29-10-9-21-33(29)22-26-13-17-28(32)18-14-26/h9-18,21H,4-8,19-20,22-24H2,1-3H3