2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)butan-2-yl]benzamide Openeye Name: 2-bromo-N-[3-methylsulfanyl-1-(4-phenylpiperazine-1-carbonyl)propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-oxo-1-(4-phenyl-1-piperazinyl)butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]benzamide Traditional Name: 2-bromo-N-[3-(methylthio)-1-(4-phenylpiperazine-1-carbonyl)propyl]benzamide Formula: C22H26BrN3O2S MolecularWeight: 476.42974

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CSCCC(C(=O)N1CCN(CC1)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C22H26BrN3O2S/c1-29-16-11-20(24-21(27)18-9-5-6-10-19(18)23)22(28)26-14-12-25(13-15-26)17-7-3-2-4-8-17/h2-10,20H,11-16H2,1H3,(H,24,27)