2-[4-(diphenylmethyl)piperazin-1-yl]-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-5-[(4-hydroxy-3-methoxy-phenyl)methylene]thiazol-4-one CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(4-benzhydrylpiperazino)-5-vanillylidene-2-thiazolin-4-one Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C28H27N3O3S/c1-34-24-18-20(12-13-23(24)32)19-25-27(33)29-28(35-25)31-16-14-30(15-17-31)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18-19,26,32H,14-17H2,1H3