(E)-3-(1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-yl)but-3-enoate

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-yl)but-3-enoate Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-furyl)but-3-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-furanyl)-3-butenoate IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(5-methylfuran-2-yl)but-3-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-furyl)but-3-enoate Formula: C16H12NO3S- MolecularWeight: 298.33638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(O1)/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO3S/c1-10-6-7-12(20-10)8-11(9-15(18)19)16-17-13-4-2-3-5-14(13)21-16/h2-8H,9H2,1H3,(H,18,19)/p-1/b11-8+