N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-[(4-ethoxyphenyl)carbamoyl-propan-2-yl-amino]ethanamide

Systemtic Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-[(4-ethoxyphenyl)carbamoyl-propan-2-yl-amino]ethanamide Openeye Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-[(4-ethoxyphenyl)carbamoyl-isopropyl-amino]acetamide CAS Name: N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexyl-2-[[(4-ethoxyanilino)-oxomethyl]-propan-2-ylamino]acetamide IUPAC Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-[(4-ethoxyphenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-2-[isopropyl(p-phenetylcarbamoyl)amino]acetamide Formula: C32H41BrN4O3 MolecularWeight: 609.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

InChI

InChI=1S/C32H41BrN4O3/c1-4-40-30-18-16-27(17-19-30)34-32(39)36(24(2)3)23-31(38)37(28-9-6-5-7-10-28)22-29-11-8-20-35(29)21-25-12-14-26(33)15-13-25/h8,11-20,24,28H,4-7,9-10,21-23H2,1-3H3,(H,34,39)