2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate CAS Name: 2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-[[(E)-3-(3-bromophenyl)prop-2-enylidene]amino]phenolate Formula: C22H14BrN2OS- MolecularWeight: 434.32836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)N=CC=CC4=CC(=CC=C4)Br)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)N=C/C=C/C4=CC(=CC=C4)Br)[O-]

InChI

InChI=1S/C22H15BrN2OS/c23-16-7-3-5-15(13-16)6-4-12-24-17-10-11-18(20(26)14-17)22-25-19-8-1-2-9-21(19)27-22/h1-14,26H/p-1/b6-4+,24-12?