N-[2-oxidanylidene-2-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethyl]benzamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethyl]benzamide Openeye Name: N-[2-oxo-2-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]ethyl]benzamide CAS Name: N-[2-oxo-2-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]ethyl]benzamide IUPAC Name: N-[2-oxo-2-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]ethyl]benzamide Traditional Name: N-[2-keto-2-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]ethyl]benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC(=O)C2=CC=CC=C2)C(=O)C3CC3C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CNC(=O)C2=CC=CC=C2)C(=O)C3CC3C4=CC=CS4

InChI

InChI=1S/C21H23N3O3S/c25-19(14-22-20(26)15-5-2-1-3-6-15)23-8-10-24(11-9-23)21(27)17-13-16(17)18-7-4-12-28-18/h1-7,12,16-17H,8-11,13-14H2,(H,22,26)