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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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