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

Systemtic Name: 2-[butan-2-yl(2-methoxyethanoyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-[(2-methoxyacetyl)-sec-butyl-amino]acetamide CAS Name: 2-[butan-2-yl-(2-methoxy-1-oxoethyl)amino]-N-cyclohexyl-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]acetamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-2-[butan-2-yl-(2-methoxyacetyl)amino]-N-cyclohexylacetamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-[(2-methoxyacetyl)-sec-butyl-amino]acetamide Formula: C27H39N3O3 MolecularWeight: 453.61686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(=O)COC

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(=O)COC

InChI

InChI=1S/C27H39N3O3/c1-4-22(2)29(27(32)21-33-3)20-26(31)30(24-14-9-6-10-15-24)19-25-16-11-17-28(25)18-23-12-7-5-8-13-23/h5,7-8,11-13,16-17,22,24H,4,6,9-10,14-15,18-21H2,1-3H3