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

Systemtic Name: (4-phenoxyphenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-phenoxyphenyl)methanone CAS Name: (4-phenoxyphenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (4-phenoxyphenyl)-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]-(4-phenoxyphenyl)methanone Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2S/c1-19(2)23-9-6-10-24-25(23)28-27(33-24)30-17-15-29(16-18-30)26(31)20-11-13-22(14-12-20)32-21-7-4-3-5-8-21/h3-14,19H,15-18H2,1-2H3