(3-bromophenyl)-[4-[(5-methyl-1,2-benzothiazol-3-yl)carbonyl]piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[(5-methyl-1,2-benzothiazol-3-yl)carbonyl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(5-methyl-1,2-benzothiazole-3-carbonyl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[(5-methyl-1,2-benzothiazol-3-yl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(5-methyl-1,2-benzothiazole-3-carbonyl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(5-methyl-1,2-benzothiazole-3-carbonyl)piperazino]methanone Formula: C20H18BrN3O2S MolecularWeight: 444.34482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)SN=C2C(=O)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H18BrN3O2S/c1-13-5-6-17-16(11-13)18(22-27-17)20(26)24-9-7-23(8-10-24)19(25)14-3-2-4-15(21)12-14/h2-6,11-12H,7-10H2,1H3