(E)-3-(1,3-benzothiazol-2-yl)-4-thiophen-3-yl-but-3-enoic acid

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-4-thiophen-3-yl-but-3-enoic acid Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(3-thienyl)but-3-enoic acid CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(3-thiophenyl)-3-butenoic acid IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-4-thiophen-3-ylbut-3-enoic acid Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(3-thienyl)but-3-enoic acid Formula: C15H11NO2S2 MolecularWeight: 301.38334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=CC3=CSC=C3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=C/C3=CSC=C3)/CC(=O)O

InChI

InChI=1S/C15H11NO2S2/c17-14(18)8-11(7-10-5-6-19-9-10)15-16-12-3-1-2-4-13(12)20-15/h1-7,9H,8H2,(H,17,18)/b11-7+