2-[butan-2-yl(2-phenylsulfanylethanoyl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: 2-[butan-2-yl(2-phenylsulfanylethanoyl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: N-(2-furylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[(2-phenylsulfanylacetyl)-sec-butyl-amino]acetamide CAS Name: 2-[butan-2-yl-[1-oxo-2-(phenylthio)ethyl]amino]-N-(2-furanylmethyl)-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[butan-2-yl-(2-phenylsulfanylacetyl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: N-(2-furfuryl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[[2-(phenylthio)acetyl]-sec-butyl-amino]acetamide Formula: C25H31N3O3S MolecularWeight: 453.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CN1C)CC2=CC=CO2)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CN1C)CC2=CC=CO2)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O3S/c1-4-20(2)28(25(30)19-32-23-12-6-5-7-13-23)18-24(29)27(17-22-11-9-15-31-22)16-21-10-8-14-26(21)3/h5-15,20H,4,16-19H2,1-3H3