bis(1,3-benzothiazol-2-ylmethyl) (E)-but-2-enedioate

Systemtic Name: bis(1,3-benzothiazol-2-ylmethyl) (E)-but-2-enedioate Openeye Name: bis(1,3-benzothiazol-2-ylmethyl) (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid bis(1,3-benzothiazol-2-ylmethyl) ester IUPAC Name: bis(1,3-benzothiazol-2-ylmethyl) (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis(1,3-benzothiazol-2-ylmethyl) ester Formula: C20H14N2O4S2 MolecularWeight: 410.46616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)C=CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)/C=C/C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H14N2O4S2/c23-19(25-11-17-21-13-5-1-3-7-15(13)27-17)9-10-20(24)26-12-18-22-14-6-2-4-8-16(14)28-18/h1-10H,11-12H2/b10-9+