2-bromanyl-N-[3-methyl-1-oxidanylidene-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[3-methyl-1-oxidanylidene-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Openeye Name: 2-bromo-N-[2-methyl-1-[4-(3-thienylmethyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 2-bromo-N-[3-methyl-1-oxo-1-[4-(3-thiophenylmethyl)-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[3-methyl-1-oxo-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Traditional Name: 2-bromo-N-[2-methyl-1-[4-(3-thenyl)piperazine-1-carbonyl]propyl]benzamide Formula: C21H26BrN3O2S MolecularWeight: 464.41904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CSC=C2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CSC=C2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H26BrN3O2S/c1-15(2)19(23-20(26)17-5-3-4-6-18(17)22)21(27)25-10-8-24(9-11-25)13-16-7-12-28-14-16/h3-7,12,14-15,19H,8-11,13H2,1-2H3,(H,23,26)