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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-4-ethyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-4-ethyl-N-isopropyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-4-ethyl-N-propan-2-ylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-4-ethyl-N-propan-2-ylbenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-4-ethyl-N-isopropyl-benzamide Formula: C32H40BrN3O2 MolecularWeight: 578.5829

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

InChI

InChI=1S/C32H40BrN3O2/c1-4-25-12-16-27(17-13-25)32(38)35(24(2)3)23-31(37)36(29-9-6-5-7-10-29)22-30-11-8-20-34(30)21-26-14-18-28(33)19-15-26/h8,11-20,24,29H,4-7,9-10,21-23H2,1-3H3