(2-bromanyl-5-methoxy-phenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2-bromanyl-5-methoxy-phenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: (2-bromo-5-methoxy-phenyl)-[4-[(4-phenylthiazol-2-yl)methyl]piperazin-1-yl]methanone CAS Name: (2-bromo-5-methoxyphenyl)-[4-[(4-phenyl-2-thiazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-bromo-5-methoxyphenyl)-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: (2-bromo-5-methoxy-phenyl)-[4-[(4-phenylthiazol-2-yl)methyl]piperazino]methanone Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H22BrN3O2S/c1-28-17-7-8-19(23)18(13-17)22(27)26-11-9-25(10-12-26)14-21-24-20(15-29-21)16-5-3-2-4-6-16/h2-8,13,15H,9-12,14H2,1H3