2-[butyl(dimethylcarbamoyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide

Systemtic Name: 2-[butyl(dimethylcarbamoyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butyl(dimethylcarbamoyl)amino]-N-cyclohexyl-acetamide CAS Name: 2-[butyl-[dimethylamino(oxo)methyl]amino]-N-cyclohexyl-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]acetamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butyl(dimethylcarbamoyl)amino]-N-cyclohexylacetamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butyl(dimethylcarbamoyl)amino]-N-cyclohexyl-acetamide Formula: C27H40N4O2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H40N4O2/c1-4-5-18-30(27(33)28(2)3)22-26(32)31(24-15-10-7-11-16-24)21-25-17-12-19-29(25)20-23-13-8-6-9-14-23/h6,8-9,12-14,17,19,24H,4-5,7,10-11,15-16,18,20-22H2,1-3H3