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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N(CC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4)C(C)C

InChI

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