(E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromanylthiophen-2-yl)pent-4-enoate

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromanylthiophen-2-yl)pent-4-enoate Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromo-2-thienyl)pent-4-enoate CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromo-2-thiophenyl)-4-pentenoate IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromothiophen-2-yl)pent-4-enoate Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(5-bromo-2-thienyl)pent-4-enoate Formula: C16H11BrNO2S2- MolecularWeight: 393.29804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(S3)Br)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=C/C3=CC=C(S3)Br)/CCC(=O)[O-]

InChI

InChI=1S/C16H12BrNO2S2/c17-14-7-6-11(21-14)9-10(5-8-15(19)20)16-18-12-3-1-2-4-13(12)22-16/h1-4,6-7,9H,5,8H2,(H,19,20)/p-1/b10-9+