N-[3-[butyl(phenyl)amino]propyl]-5-[(3-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide

Systemtic Name: N-[3-[butyl(phenyl)amino]propyl]-5-[(3-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide Openeye Name: N-[3-(N-butylanilino)propyl]-5-(m-tolylmethylsulfonylmethyl)furan-2-carboxamide CAS Name: N-[3-(N-butylanilino)propyl]-5-[(3-methylphenyl)methylsulfonylmethyl]-2-furancarboxamide IUPAC Name: N-[3-(N-butylanilino)propyl]-5-[(3-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide Traditional Name: N-[3-(N-butylanilino)propyl]-5-[(3-methylbenzyl)sulfonylmethyl]-2-furamide Formula: C27H34N2O4S MolecularWeight: 482.63486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC=CC(=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCN(CCCNC(=O)C1=CC=C(O1)CS(=O)(=O)CC2=CC=CC(=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C27H34N2O4S/c1-3-4-17-29(24-12-6-5-7-13-24)18-9-16-28-27(30)26-15-14-25(33-26)21-34(31,32)20-23-11-8-10-22(2)19-23/h5-8,10-15,19H,3-4,9,16-18,20-21H2,1-2H3,(H,28,30)