4-butoxy-N-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-butoxy-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-butoxy-N-[4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-butoxy-N-[4-[4-(2-thenoyl)piperazino]phenyl]benzamide Formula: C26H29N3O3S MolecularWeight: 463.59176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C26H29N3O3S/c1-2-3-18-32-23-12-6-20(7-13-23)25(30)27-21-8-10-22(11-9-21)28-14-16-29(17-15-28)26(31)24-5-4-19-33-24/h4-13,19H,2-3,14-18H2,1H3,(H,27,30)