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

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-4-[(2-methyl-4-thiazolyl)methylthio]benzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-4-[(2-methylthiazol-4-yl)methylthio]benzamide Formula: C22H21ClN4O2S2 MolecularWeight: 473.01074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C22H21ClN4O2S2/c1-14-25-17(12-30-14)13-31-18-5-2-15(3-6-18)22(29)26-16-4-7-20(19(23)10-16)27-9-8-24-21(28)11-27/h2-7,10,12H,8-9,11,13H2,1H3,(H,24,28)(H,26,29)