N-(4-acetamidophenyl)-4-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoylamino]benzamide

Systemtic Name: N-(4-acetamidophenyl)-4-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoylamino]benzamide Openeye Name: N-(4-acetamidophenyl)-4-[(1,1-dioxothiolan-3-yl)carbamoylamino]benzamide CAS Name: N-(4-acetamidophenyl)-4-[[[(1,1-dioxo-3-thiolanyl)amino]-oxomethyl]amino]benzamide IUPAC Name: N-(4-acetamidophenyl)-4-[(1,1-dioxothiolan-3-yl)carbamoylamino]benzamide Traditional Name: N-(4-acetamidophenyl)-4-[(1,1-diketothiolan-3-yl)carbamoylamino]benzamide Formula: C20H22N4O5S MolecularWeight: 430.47748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C20H22N4O5S/c1-13(25)21-15-6-8-16(9-7-15)22-19(26)14-2-4-17(5-3-14)23-20(27)24-18-10-11-30(28,29)12-18/h2-9,18H,10-12H2,1H3,(H,21,25)(H,22,26)(H2,23,24,27)