N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-dimethylaminophenyl)methyl]-4-pentoxy-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-dimethylaminophenyl)methyl]-4-pentoxy-benzamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-4-pentoxy-benzamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]-4-pentoxybenzamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[(3S)-1,1-diketothiolan-3-yl]-N-[4-(dimethylamino)benzyl]benzamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N(C)C)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)N(C)C)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C25H34N2O4S/c1-4-5-6-16-31-24-13-9-21(10-14-24)25(28)27(23-15-17-32(29,30)19-23)18-20-7-11-22(12-8-20)26(2)3/h7-14,23H,4-6,15-19H2,1-3H3/t23-/m0/s1