4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]benzamide Openeye Name: 4-[(4-methylthiazol-2-yl)sulfanylmethyl]-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide CAS Name: 4-[[(4-methyl-2-thiazolyl)thio]methyl]-N-[4-(3-oxo-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[4-(3-oxopiperazin-1-yl)phenyl]benzamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H22N4O2S2/c1-15-13-29-22(24-15)30-14-16-2-4-17(5-3-16)21(28)25-18-6-8-19(9-7-18)26-11-10-23-20(27)12-26/h2-9,13H,10-12,14H2,1H3,(H,23,27)(H,25,28)