(E)-4-[[5-(1,3-dimethyl-6,7-dihydro-2-benzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[5-(1,3-dimethyl-6,7-dihydro-2-benzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[5-(1,3-dimethyl-6,7-dihydro-2-benzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-oxo-but-2-enoate CAS Name: (E)-4-[[5-(1,3-dimethyl-6,7-dihydro-2-benzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[5-(1,3-dimethyl-6,7-dihydro-2-benzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-oxobut-2-enoate Traditional Name: (E)-4-[[5-(1,3-dimethyl-6,7-dihydroisobenzothiophen-4-yl)-1H-imidazol-2-yl]oxy]-4-keto-but-2-enoate Formula: C17H15N2O4S- MolecularWeight: 343.377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC=C(C2=C(S1)C)C3=CN=C(N3)OC(=O)C=CC(=O)[O-]

Isomeric SMILES

CC1=C2CCC=C(C2=C(S1)C)C3=CN=C(N3)OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C17H16N2O4S/c1-9-11-4-3-5-12(16(11)10(2)24-9)13-8-18-17(19-13)23-15(22)7-6-14(20)21/h5-8H,3-4H2,1-2H3,(H,18,19)(H,20,21)/p-1/b7-6+