(E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-bromophenyl)prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-bromophenyl)prop-2-enoate Openeye Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-bromophenyl)prop-2-enoate CAS Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-bromophenyl)-2-propenoate IUPAC Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-bromophenyl)prop-2-enoate Traditional Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-bromophenyl)acrylate Formula: C16H9BrNO2S2- MolecularWeight: 391.28216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=CC3=CC=C(C=C3)Br)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrNO2S2/c17-11-7-5-10(6-8-11)9-14(15(19)20)22-16-18-12-3-1-2-4-13(12)21-16/h1-9H,(H,19,20)/p-1/b14-9+