(E)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-phenylmethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-phenylmethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(4-benzyloxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(4-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-phenylmethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(1,3-benzothiazol-2-yl)piperidino]-3-(4-benzoxyphenyl)prop-2-en-1-one Formula: C28H26N2O2S MolecularWeight: 454.58324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C=CC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)/C=C/C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O2S/c31-27(15-12-21-10-13-24(14-11-21)32-20-22-6-2-1-3-7-22)30-18-16-23(17-19-30)28-29-25-8-4-5-9-26(25)33-28/h1-15,23H,16-20H2/b15-12+