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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-ethylphenyl)methyl]-3-propoxy-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-ethylphenyl)methyl]-3-propoxy-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(4-ethylphenyl)methyl]-3-propoxybenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-ethylphenyl)methyl]-3-propoxybenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-(4-ethylbenzyl)-3-propoxy-benzamide Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=C(C=C2)CC)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=C(C=C2)CC)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C23H29NO4S/c1-3-13-28-22-7-5-6-20(15-22)23(25)24(21-12-14-29(26,27)17-21)16-19-10-8-18(4-2)9-11-19/h5-11,15,21H,3-4,12-14,16-17H2,1-2H3/t21-/m0/s1