(5E)-5-(phenanthren-9-ylmethylidene)-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one

Systemtic Name: (5E)-5-(phenanthren-9-ylmethylidene)-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one Openeye Name: (5E)-5-(9-phenanthrylmethylene)-2-(4-phenylpiperazin-1-yl)thiazol-4-one CAS Name: (5E)-5-(9-phenanthrenylmethylidene)-2-(4-phenyl-1-piperazinyl)-4-thiazolone IUPAC Name: (5E)-5-(phenanthren-9-ylmethylidene)-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-4-one Traditional Name: (5E)-5-(9-phenanthrylmethylene)-2-(4-phenylpiperazino)-2-thiazolin-4-one Formula: C28H23N3OS MolecularWeight: 449.56672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC(=O)C(=CC4=CC5=CC=CC=C5C6=CC=CC=C64)S3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC(=O)/C(=C\C4=CC5=CC=CC=C5C6=CC=CC=C64)/S3

InChI

InChI=1S/C28H23N3OS/c32-27-26(19-21-18-20-8-4-5-11-23(20)25-13-7-6-12-24(21)25)33-28(29-27)31-16-14-30(15-17-31)22-9-2-1-3-10-22/h1-13,18-19H,14-17H2/b26-19+