4-(methylsulfanylmethyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-(methylsulfanylmethyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide Openeye Name: 4-(methylsulfanylmethyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide CAS Name: 4-[(methylthio)methyl]-N-[4-(3-oxo-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-(methylsulfanylmethyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-4-[(methylthio)methyl]benzamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C19H21N3O2S/c1-25-13-14-2-4-15(5-3-14)19(24)21-16-6-8-17(9-7-16)22-11-10-20-18(23)12-22/h2-9H,10-13H2,1H3,(H,20,23)(H,21,24)