5-[[2-[[(2-methylphenyl)carbonyl-propyl-amino]methyl]pyrrol-1-yl]methyl]-N-pentyl-furan-2-carboxamide

Systemtic Name: 5-[[2-[[(2-methylphenyl)carbonyl-propyl-amino]methyl]pyrrol-1-yl]methyl]-N-pentyl-furan-2-carboxamide Openeye Name: 5-[[2-[[(2-methylbenzoyl)-propyl-amino]methyl]pyrrol-1-yl]methyl]-N-pentyl-furan-2-carboxamide CAS Name: 5-[[2-[[[(2-methylphenyl)-oxomethyl]-propylamino]methyl]-1-pyrrolyl]methyl]-N-pentyl-2-furancarboxamide IUPAC Name: 5-[[2-[[(2-methylbenzoyl)-propylamino]methyl]pyrrol-1-yl]methyl]-N-pentylfuran-2-carboxamide Traditional Name: N-amyl-5-[[2-[[o-toluoyl(propyl)amino]methyl]pyrrol-1-yl]methyl]-2-furamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=C(O1)CN2C=CC=C2CN(CCC)C(=O)C3=CC=CC=C3C

Isomeric SMILES

CCCCCNC(=O)C1=CC=C(O1)CN2C=CC=C2CN(CCC)C(=O)C3=CC=CC=C3C

InChI

InChI=1S/C27H35N3O3/c1-4-6-9-16-28-26(31)25-15-14-23(33-25)20-29-18-10-12-22(29)19-30(17-5-2)27(32)24-13-8-7-11-21(24)3/h7-8,10-15,18H,4-6,9,16-17,19-20H2,1-3H3,(H,28,31)