[4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(phenylmethyl)phenyl]methanone

Systemtic Name: [4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(phenylmethyl)phenyl]methanone Openeye Name: (4-benzylphenyl)-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [4-(6-bromo-1,3-benzothiazol-2-yl)-1-piperazinyl]-[4-(phenylmethyl)phenyl]methanone IUPAC Name: (4-benzylphenyl)-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (4-benzylphenyl)-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C25H22BrN3OS MolecularWeight: 492.43068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H22BrN3OS/c26-21-10-11-22-23(17-21)31-25(27-22)29-14-12-28(13-15-29)24(30)20-8-6-19(7-9-20)16-18-4-2-1-3-5-18/h1-11,17H,12-16H2