2-[butan-2-yl(butylcarbamoyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide

Systemtic Name: 2-[butan-2-yl(butylcarbamoyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butylcarbamoyl(sec-butyl)amino]-N-cyclohexyl-acetamide CAS Name: 2-[butan-2-yl-[butylamino(oxo)methyl]amino]-N-cyclohexyl-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]acetamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butan-2-yl(butylcarbamoyl)amino]-N-cyclohexylacetamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butylcarbamoyl(sec-butyl)amino]-N-cyclohexyl-acetamide Formula: C29H44N4O2 MolecularWeight: 480.68526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(C)CC

Isomeric SMILES

CCCCNC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(C)CC

InChI

InChI=1S/C29H44N4O2/c1-4-6-19-30-29(35)32(24(3)5-2)23-28(34)33(26-16-11-8-12-17-26)22-27-18-13-20-31(27)21-25-14-9-7-10-15-25/h7,9-10,13-15,18,20,24,26H,4-6,8,11-12,16-17,19,21-23H2,1-3H3,(H,30,35)