2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Openeye Name: 2-bromo-N-[3-methylsulfanyl-1-[4-(2-thienylmethyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-oxo-1-[4-(thiophen-2-ylmethyl)-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-oxo-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Traditional Name: 2-bromo-N-[3-(methylthio)-1-[4-(2-thenyl)piperazine-1-carbonyl]propyl]benzamide Formula: C21H26BrN3O2S2 MolecularWeight: 496.48404

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)CC2=CC=CS2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CSCCC(C(=O)N1CCN(CC1)CC2=CC=CS2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H26BrN3O2S2/c1-28-14-8-19(23-20(26)17-6-2-3-7-18(17)22)21(27)25-11-9-24(10-12-25)15-16-5-4-13-29-16/h2-7,13,19H,8-12,14-15H2,1H3,(H,23,26)