5-[(2-methylphenyl)sulfinylmethyl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]furan-2-carboxamide

Systemtic Name: 5-[(2-methylphenyl)sulfinylmethyl]-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]furan-2-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-5-(o-tolylsulfinylmethyl)furan-2-carboxamide CAS Name: 5-[(2-methylphenyl)sulfinylmethyl]-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-2-furancarboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-5-[(2-methylphenyl)sulfinylmethyl]furan-2-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-5-(o-tolylsulfinylmethyl)-2-furamide Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)CC2=CC=C(O2)C(=O)NCCCN(CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=CC=CC=C1S(=O)CC2=CC=C(O2)C(=O)NCCCN(CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C26H32N2O3S/c1-20(2)28(18-22-11-5-4-6-12-22)17-9-16-27-26(29)24-15-14-23(31-24)19-32(30)25-13-8-7-10-21(25)3/h4-8,10-15,20H,9,16-19H2,1-3H3,(H,27,29)