5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazolidin-4-one

Systemtic Name: 5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-3-(phenylmethyl)-2-(phenylmethyl)imino-1,3-thiazolidin-4-one Openeye Name: 3-benzyl-2-benzylimino-5-[(5-bromo-3-methoxy-2-prop-2-ynoxy-phenyl)methylene]thiazolidin-4-one CAS Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-3-(phenylmethyl)-2-(phenylmethyl)imino-4-thiazolidinone IUPAC Name: 3-benzyl-2-benzylimino-5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-1,3-thiazolidin-4-one Traditional Name: 3-benzyl-2-benzylimino-5-(5-bromo-3-methoxy-2-propargyloxy-benzylidene)thiazolidin-4-one Formula: C28H23BrN2O3S MolecularWeight: 547.46282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C=C2C(=O)N(C(=NCC3=CC=CC=C3)S2)CC4=CC=CC=C4)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C=C2C(=O)N(C(=NCC3=CC=CC=C3)S2)CC4=CC=CC=C4)OCC#C

InChI

InChI=1S/C28H23BrN2O3S/c1-3-14-34-26-22(15-23(29)17-24(26)33-2)16-25-27(32)31(19-21-12-8-5-9-13-21)28(35-25)30-18-20-10-6-4-7-11-20/h1,4-13,15-17H,14,18-19H2,2H3