N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(3-oxo-1-piperazinyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H24N4O4S2 MolecularWeight: 448.55896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H24N4O4S2/c25-18-14-23(12-9-21-18)17-5-3-16(4-6-17)22-20(26)15-7-10-24(11-8-15)30(27,28)19-2-1-13-29-19/h1-6,13,15H,7-12,14H2,(H,21,25)(H,22,26)