3-butoxy-N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 3-butoxy-N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 3-butoxy-N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-butoxy-N-[3-chloro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-butoxy-N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-butoxy-N-[3-chloro-4-[4-(2-thenoyl)piperazino]phenyl]benzamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClN3O3S/c1-2-3-15-33-21-7-4-6-19(17-21)25(31)28-20-9-10-23(22(27)18-20)29-11-13-30(14-12-29)26(32)24-8-5-16-34-24/h4-10,16-18H,2-3,11-15H2,1H3,(H,28,31)