(3-bromophenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C21H22BrN3OS MolecularWeight: 444.38788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H22BrN3OS/c1-14(2)17-7-4-8-18-19(17)23-21(27-18)25-11-9-24(10-12-25)20(26)15-5-3-6-16(22)13-15/h3-8,13-14H,9-12H2,1-2H3